 vasp.6.3.2 27Jun22 (build Feb 06 2023 14:45:50) complex                        
  
 executed on             LinuxIFC date 2023.03.21  10:16:22
 running on   16 total cores
 distrk:  each k-point on   16 cores,    1 groups
 distr:  one band on NCORE=   4 cores,    4 groups


--------------------------------------------------------------------------------------------------------


 INCAR:
   SYSTEM = Al Lattice Relaxation  HSE06-1/2x vdW-DF2, Ionic Relaxation
   GGA = PE
   LHFCALC = .TRUE.
   HFSCREEN = 0.2
   AEXX = 0.5
   AGGAC = 0.0
   LUSE_VDW = .TRUE.
   ZAB_VDW = -1.8667
   LASPH = .TRUE.
   PREC = Accurate
   ALGO = Damped
   TIME = 0.2
   ENCUT = 400
   NELM = 100
   NELMIN = 2
   ICHARGE = 1
   ISTART = 1
   ISPIN = 2
   ISYM = 0
   ISMEAR = 1
   SIGMA = 0.2
   IBRION = 1
   NSW = 100
   EDIFFG = -0.005
   ADDGRID = .TRUE.
   EDIFF = 1.E-5
   LCHARGE = .TRUE.
   LWAVE = .TRUE.
   NPAR = 4
   DEFAULT = Nr_Cores
   OPTIMUM = sqrt(Nr_Cores) and int multpl of Nr_Cores
   KPAR = 1
   LPLANE = .TRUE.
   NSIM = 4

 POTCAR:    PAW_PBE Al 04Jan2001                  
 -----------------------------------------------------------------------------
|                                                                             |
|           W    W    AA    RRRRR   N    N  II  N    N   GGGG   !!!           |
|           W    W   A  A   R    R  NN   N  II  NN   N  G    G  !!!           |
|           W    W  A    A  R    R  N N  N  II  N N  N  G       !!!           |
|           W WW W  AAAAAA  RRRRR   N  N N  II  N  N N  G  GGG   !            |
|           WW  WW  A    A  R   R   N   NN  II  N   NN  G    G                |
|           W    W  A    A  R    R  N    N  II  N    N   GGGG   !!!           |
|                                                                             |
|     You use a magnetic or noncollinear calculation, but did not specify     |
|     the initial magnetic moment with the MAGMOM tag. Note that a            |
|     default of 1 will be used for all atoms. This ferromagnetic setup       |
|     may break the symmetry of the crystal, in particular it may rule        |
|     out finding an antiferromagnetic solution. Thence, we recommend         |
|     setting the initial magnetic moment manually or verifying carefully     |
|     that this magnetic setup is desired.                                    |
|                                                                             |
 -----------------------------------------------------------------------------

 -----------------------------------------------------------------------------
|                                                                             |
|               ----> ADVICE to this user running VASP <----                  |
|                                                                             |
|     You have switched on vdW-DFT.                                           |
|     This routine was written and supplied by Jiri Klimes. We recommend      |
|     that you carefully read and cite the following publications:            |
|       J. Klimes, D.R. Bowler, A. Michelides                                 |
|          J. Phys.: Cond Matt. 22 022201 (2010)                              |
|       J. Klimes, D.R. Bowler, A. Michelides                                 |
|          Phys. Rev. B. 83, 195131 (2011)                                    |
|     and references therein.                                                 |
|                                                                             |
 -----------------------------------------------------------------------------

 POTCAR:    PAW_PBE Al 04Jan2001                  
   VRHFIN =Al: s2p1                                                                                 
   LEXCH  = PE                                                                                      
   EATOM  =    53.5387 eV,    3.9350 Ry                                                             
                                                                                                    
   TITEL  = PAW_PBE Al 04Jan2001                                                                    
   LULTRA =        F    use ultrasoft PP ?                                                          
   IUNSCR =        1    unscreen: 0-lin 1-nonlin 2-no                                               
   RPACOR =    1.500    partial core radius                                                         
   POMASS =   26.981; ZVAL   =    3.000    mass and valenz                                          
   RCORE  =    1.900    outmost cutoff radius                                                       
   RWIGS  =    2.650; RWIGS  =    1.402    wigner-seitz radius (au A)                               
   ENMAX  =  240.300; ENMIN  =  180.225 eV                                                          
   ICORE  =        2    local potential                                                             
   LCOR   =        T    correct aug charges                                                         
   LPAW   =        T    paw PP                                                                      
   EAUG   =  291.052                                                                                
   DEXC   =    0.000                                                                                
   RMAX   =    1.939    core radius for proj-oper                                                   
   RAUG   =    1.300    factor for augmentation sphere                                              
   RDEP   =    1.966    radius for radial grids                                                     
   RDEPT  =    1.856    core radius for aug-charge                                                  
                                                                                                    
   Atomic configuration                                                                             
    6 entries                                                                                       
     n  l   j            E        occ.                                                              
     1  0  0.50     -1511.1048   2.0000                                                             
     2  0  0.50      -108.1629   2.0000                                                             
     2  1  1.50       -69.6402   6.0000                                                             
     3  0  0.50        -7.7528   2.0000                                                             
     3  1  1.50        -2.7121   1.0000                                                             
     3  2  2.50        -2.7212   0.0000                                                             
   Description                                                                                      
     l       E           TYP  RCUT    TYP  RCUT                                                     
     0     -7.7528455     23  1.900                                                                 
     0     -3.3096929     23  1.900                                                                 
     1     -2.7120682     23  1.900                                                                 
     1     13.6058260     23  1.900                                                                 
     2     -2.7211652      7  1.900                                                                 
  local pseudopotential read in
  partial core-charges read in
  partial kinetic energy density read in
  atomic valenz-charges read in
  non local Contribution for L=           0  read in
    real space projection operators read in
  non local Contribution for L=           0  read in
    real space projection operators read in
  non local Contribution for L=           1  read in
    real space projection operators read in
  non local Contribution for L=           1  read in
    real space projection operators read in
    PAW grid and wavefunctions read in
 
   number of l-projection  operators is LMAX  =           4
   number of lm-projection operators is LMMAX =           8
 
  PAW_PBE Al 04Jan2001                  :
 energy of atom  1       EATOM=  -53.5387
 kinetic energy error for atom=    0.0005 (will be added to EATOM!!)
 
 
 POSCAR: Al
  positions in cartesian coordinates
  No initial velocities read in
 exchange correlation table for  LEXCH =        8
   RHO(1)=    0.500       N(1)  =     2000
   RHO(2)=  100.500       N(2)  =     4000
 


--------------------------------------------------------------------------------------------------------


 ion  position               nearest neighbor table
   1  0.000  0.000  0.000-   2 2.86   2 2.86   2 2.86
   2  0.333  0.333  0.137-   1 2.86   1 2.86   1 2.86   3 2.86   3 2.86   3 2.86
   3  0.667  0.667  0.274-   4 2.86   4 2.86   4 2.86   2 2.86   2 2.86   2 2.86
   4  0.000  0.000  0.412-   3 2.86   3 2.86   3 2.86
 

IMPORTANT INFORMATION: All symmetrisations will be switched off!
NOSYMM: (Re-)initialisation of all symmetry stuff for point group C_1.


----------------------------------------------------------------------------------------

                                     Primitive cell                                     

  volume of cell :     120.2050

  direct lattice vectors                    reciprocal lattice vectors
     2.857459769  0.000000000  0.000000000     0.349961183 -0.202050183  0.000000000
     1.428729885  2.474632750  0.000000000     0.000000000  0.404100366  0.000000000
     0.000000000  0.000000000 16.999318395     0.000000000  0.000000000  0.058825888

  length of vectors
     2.857459769  2.857459769 16.999318395     0.404100366  0.404100366  0.058825888

  position of ions in fractional coordinates (direct lattice)
     0.000000000  0.000000000  0.000000000
     0.333333333  0.333333333  0.137247040
     0.666666667  0.666666667  0.274494080
     0.000000000  0.000000000  0.411741120

  ion indices of the primitive-cell ions
   primitive index   ion index
                 1           1
                 2           2
                 3           3
                 4           4

----------------------------------------------------------------------------------------

 
 
 KPOINTS: Automatic Mesh                          

Automatic generation of k-mesh.
 Grid dimensions read from file:
 generate k-points for:   20   20    1

 Generating k-lattice:

  Cartesian coordinates                     Fractional coordinates (reciprocal lattice)
     0.017498059 -0.010102509  0.000000000     0.050000000  0.000000000  0.000000000
     0.000000000  0.020205018  0.000000000     0.000000000  0.050000000  0.000000000
     0.000000000  0.000000000  0.058825888     0.000000000  0.000000000  1.000000000

  Length of vectors
     0.020205018  0.020205018  0.058825888

  Shift w.r.t. Gamma in fractional coordinates (k-lattice)
     0.000000000  0.000000000  0.000000000

 
 Subroutine IBZKPT returns following result:
 ===========================================
 
 Found    202 irreducible k-points:
 
 Following reciprocal coordinates:
            Coordinates               Weight
  0.000000  0.000000  0.000000      1.000000
  0.050000 -0.000000  0.000000      2.000000
  0.050000  0.050000  0.000000      2.000000
  0.000000  0.050000  0.000000      2.000000
  0.100000  0.000000  0.000000      2.000000
  0.100000  0.100000  0.000000      2.000000
  0.000000  0.100000  0.000000      2.000000
  0.150000 -0.000000  0.000000      2.000000
  0.150000  0.150000  0.000000      2.000000
  0.000000  0.150000  0.000000      2.000000
  0.200000  0.000000  0.000000      2.000000
  0.200000  0.200000  0.000000      2.000000
  0.000000  0.200000  0.000000      2.000000
  0.250000 -0.000000  0.000000      2.000000
  0.250000  0.250000  0.000000      2.000000
  0.000000  0.250000  0.000000      2.000000
  0.300000 -0.000000  0.000000      2.000000
  0.300000  0.300000  0.000000      2.000000
  0.000000  0.300000  0.000000      2.000000
  0.350000  0.000000  0.000000      2.000000
  0.350000  0.350000  0.000000      2.000000
  0.000000  0.350000  0.000000      2.000000
  0.400000 -0.000000  0.000000      2.000000
  0.400000  0.400000  0.000000      2.000000
  0.000000  0.400000  0.000000      2.000000
  0.450000 -0.000000  0.000000      2.000000
  0.450000  0.450000  0.000000      2.000000
  0.000000  0.450000  0.000000      2.000000
  0.500000 -0.000000  0.000000      1.000000
  0.500000  0.500000  0.000000      1.000000
  0.000000  0.500000  0.000000      1.000000
  0.100000  0.050000  0.000000      2.000000
  0.050000  0.100000  0.000000      2.000000
 -0.050000  0.050000  0.000000      2.000000
  0.150000  0.050000  0.000000      2.000000
  0.100000  0.150000  0.000000      2.000000
 -0.050000  0.100000  0.000000      2.000000
  0.100000 -0.050000  0.000000      2.000000
 -0.050000 -0.150000  0.000000      2.000000
 -0.150000 -0.100000  0.000000      2.000000
  0.200000  0.050000  0.000000      2.000000
  0.150000  0.200000  0.000000      2.000000
 -0.050000  0.150000  0.000000      2.000000
  0.150000 -0.050000  0.000000      2.000000
 -0.050000 -0.200000  0.000000      2.000000
 -0.200000 -0.150000  0.000000      2.000000
  0.250000  0.050000  0.000000      2.000000
  0.200000  0.250000  0.000000      2.000000
 -0.050000  0.200000  0.000000      2.000000
  0.200000 -0.050000  0.000000      2.000000
 -0.050000 -0.250000  0.000000      2.000000
 -0.250000 -0.200000  0.000000      2.000000
  0.300000  0.050000  0.000000      2.000000
  0.250000  0.300000  0.000000      2.000000
 -0.050000  0.250000  0.000000      2.000000
  0.250000 -0.050000  0.000000      2.000000
 -0.050000 -0.300000  0.000000      2.000000
 -0.300000 -0.250000  0.000000      2.000000
  0.350000  0.050000  0.000000      2.000000
  0.300000  0.350000  0.000000      2.000000
 -0.050000  0.300000  0.000000      2.000000
  0.300000 -0.050000  0.000000      2.000000
 -0.050000 -0.350000  0.000000      2.000000
 -0.350000 -0.300000  0.000000      2.000000
  0.400000  0.050000  0.000000      2.000000
  0.350000  0.400000  0.000000      2.000000
 -0.050000  0.350000  0.000000      2.000000
  0.350000 -0.050000  0.000000      2.000000
 -0.050000 -0.400000  0.000000      2.000000
 -0.400000 -0.350000  0.000000      2.000000
  0.450000  0.050000  0.000000      2.000000
  0.400000  0.450000  0.000000      2.000000
 -0.050000  0.400000  0.000000      2.000000
  0.400000 -0.050000  0.000000      2.000000
 -0.050000 -0.450000  0.000000      2.000000
 -0.450000 -0.400000  0.000000      2.000000
  0.500000  0.050000  0.000000      2.000000
  0.450000  0.500000  0.000000      2.000000
 -0.050000  0.450000  0.000000      2.000000
  0.450000 -0.050000  0.000000      2.000000
 -0.050000  0.500000  0.000000      2.000000
  0.500000 -0.450000  0.000000      2.000000
  0.200000  0.100000  0.000000      2.000000
  0.100000  0.200000  0.000000      2.000000
 -0.100000  0.100000  0.000000      2.000000
  0.250000  0.100000  0.000000      2.000000
  0.150000  0.250000  0.000000      2.000000
 -0.100000  0.150000  0.000000      2.000000
  0.150000 -0.100000  0.000000      2.000000
 -0.100000 -0.250000  0.000000      2.000000
 -0.250000 -0.150000  0.000000      2.000000
  0.300000  0.100000  0.000000      2.000000
  0.200000  0.300000  0.000000      2.000000
 -0.100000  0.200000  0.000000      2.000000
  0.200000 -0.100000  0.000000      2.000000
 -0.100000 -0.300000  0.000000      2.000000
 -0.300000 -0.200000  0.000000      2.000000
  0.350000  0.100000  0.000000      2.000000
  0.250000  0.350000  0.000000      2.000000
 -0.100000  0.250000  0.000000      2.000000
  0.250000 -0.100000  0.000000      2.000000
 -0.100000 -0.350000  0.000000      2.000000
 -0.350000 -0.250000  0.000000      2.000000
  0.400000  0.100000  0.000000      2.000000
  0.300000  0.400000  0.000000      2.000000
 -0.100000  0.300000  0.000000      2.000000
  0.300000 -0.100000  0.000000      2.000000
 -0.100000 -0.400000  0.000000      2.000000
 -0.400000 -0.300000  0.000000      2.000000
  0.450000  0.100000  0.000000      2.000000
  0.350000  0.450000  0.000000      2.000000
 -0.100000  0.350000  0.000000      2.000000
  0.350000 -0.100000  0.000000      2.000000
 -0.100000 -0.450000  0.000000      2.000000
 -0.450000 -0.350000  0.000000      2.000000
  0.500000  0.100000  0.000000      2.000000
  0.400000  0.500000  0.000000      2.000000
 -0.100000  0.400000  0.000000      2.000000
  0.400000 -0.100000  0.000000      2.000000
 -0.100000  0.500000  0.000000      2.000000
  0.500000 -0.400000  0.000000      2.000000
 -0.450000  0.100000  0.000000      2.000000
  0.450000 -0.450000  0.000000      2.000000
 -0.100000  0.450000  0.000000      2.000000
  0.300000  0.150000  0.000000      2.000000
  0.150000  0.300000  0.000000      2.000000
 -0.150000  0.150000  0.000000      2.000000
  0.350000  0.150000  0.000000      2.000000
  0.200000  0.350000  0.000000      2.000000
 -0.150000  0.200000  0.000000      2.000000
  0.200000 -0.150000  0.000000      2.000000
 -0.150000 -0.350000  0.000000      2.000000
 -0.350000 -0.200000  0.000000      2.000000
  0.400000  0.150000  0.000000      2.000000
  0.250000  0.400000  0.000000      2.000000
 -0.150000  0.250000  0.000000      2.000000
  0.250000 -0.150000  0.000000      2.000000
 -0.150000 -0.400000  0.000000      2.000000
 -0.400000 -0.250000  0.000000      2.000000
  0.450000  0.150000  0.000000      2.000000
  0.300000  0.450000  0.000000      2.000000
 -0.150000  0.300000  0.000000      2.000000
  0.300000 -0.150000  0.000000      2.000000
 -0.150000 -0.450000  0.000000      2.000000
 -0.450000 -0.300000  0.000000      2.000000
  0.500000  0.150000  0.000000      2.000000
  0.350000  0.500000  0.000000      2.000000
 -0.150000  0.350000  0.000000      2.000000
  0.350000 -0.150000  0.000000      2.000000
 -0.150000  0.500000  0.000000      2.000000
  0.500000 -0.350000  0.000000      2.000000
 -0.450000  0.150000  0.000000      2.000000
  0.400000 -0.450000  0.000000      2.000000
 -0.150000  0.400000  0.000000      2.000000
  0.400000 -0.150000  0.000000      2.000000
 -0.150000  0.450000  0.000000      2.000000
  0.450000 -0.400000  0.000000      2.000000
  0.400000  0.200000  0.000000      2.000000
  0.200000  0.400000  0.000000      2.000000
 -0.200000  0.200000  0.000000      2.000000
  0.450000  0.200000  0.000000      2.000000
  0.250000  0.450000  0.000000      2.000000
 -0.200000  0.250000  0.000000      2.000000
  0.250000 -0.200000  0.000000      2.000000
 -0.200000 -0.450000  0.000000      2.000000
 -0.450000 -0.250000  0.000000      2.000000
  0.500000  0.200000  0.000000      2.000000
  0.300000  0.500000  0.000000      2.000000
 -0.200000  0.300000  0.000000      2.000000
  0.300000 -0.200000  0.000000      2.000000
 -0.200000  0.500000  0.000000      2.000000
  0.500000 -0.300000  0.000000      2.000000
 -0.450000  0.200000  0.000000      2.000000
  0.350000 -0.450000  0.000000      2.000000
 -0.200000  0.350000  0.000000      2.000000
  0.350000 -0.200000  0.000000      2.000000
 -0.200000  0.450000  0.000000      2.000000
  0.450000 -0.350000  0.000000      2.000000
 -0.400000  0.200000  0.000000      2.000000
  0.400000 -0.400000  0.000000      2.000000
 -0.200000  0.400000  0.000000      2.000000
  0.500000  0.250000  0.000000      2.000000
  0.250000  0.500000  0.000000      2.000000
 -0.250000  0.250000  0.000000      2.000000
 -0.450000  0.250000  0.000000      2.000000
  0.300000 -0.450000  0.000000      2.000000
 -0.250000  0.300000  0.000000      2.000000
  0.300000 -0.250000  0.000000      2.000000
 -0.250000  0.450000  0.000000      2.000000
  0.450000 -0.300000  0.000000      2.000000
 -0.400000  0.250000  0.000000      2.000000
  0.350000 -0.400000  0.000000      2.000000
 -0.250000  0.350000  0.000000      2.000000
  0.350000 -0.250000  0.000000      2.000000
 -0.250000  0.400000  0.000000      2.000000
  0.400000 -0.350000  0.000000      2.000000
 -0.400000  0.300000  0.000000      2.000000
  0.300000 -0.400000  0.000000      2.000000
 -0.300000  0.300000  0.000000      2.000000
 -0.350000  0.300000  0.000000      2.000000
  0.350000 -0.350000  0.000000      2.000000
 -0.300000  0.350000  0.000000      2.000000
 
 Following cartesian coordinates:
            Coordinates               Weight
  0.000000  0.000000  0.000000      1.000000
  0.017498 -0.010103  0.000000      2.000000
  0.017498  0.010103  0.000000      2.000000
  0.000000  0.020205  0.000000      2.000000
  0.034996 -0.020205  0.000000      2.000000
  0.034996  0.020205  0.000000      2.000000
  0.000000  0.040410  0.000000      2.000000
  0.052494 -0.030308  0.000000      2.000000
  0.052494  0.030308  0.000000      2.000000
  0.000000  0.060615  0.000000      2.000000
  0.069992 -0.040410  0.000000      2.000000
  0.069992  0.040410  0.000000      2.000000
  0.000000  0.080820  0.000000      2.000000
  0.087490 -0.050513  0.000000      2.000000
  0.087490  0.050513  0.000000      2.000000
  0.000000  0.101025  0.000000      2.000000
  0.104988 -0.060615  0.000000      2.000000
  0.104988  0.060615  0.000000      2.000000
  0.000000  0.121230  0.000000      2.000000
  0.122486 -0.070718  0.000000      2.000000
  0.122486  0.070718  0.000000      2.000000
  0.000000  0.141435  0.000000      2.000000
  0.139984 -0.080820  0.000000      2.000000
  0.139984  0.080820  0.000000      2.000000
  0.000000  0.161640  0.000000      2.000000
  0.157483 -0.090923  0.000000      2.000000
  0.157483  0.090923  0.000000      2.000000
  0.000000  0.181845  0.000000      2.000000
  0.174981 -0.101025  0.000000      1.000000
  0.174981  0.101025  0.000000      1.000000
  0.000000  0.202050  0.000000      1.000000
  0.034996 -0.000000  0.000000      2.000000
  0.017498  0.030308  0.000000      2.000000
 -0.017498  0.030308  0.000000      2.000000
  0.052494 -0.010103  0.000000      2.000000
  0.034996  0.040410  0.000000      2.000000
 -0.017498  0.050513  0.000000      2.000000
  0.034996 -0.040410  0.000000      2.000000
 -0.017498 -0.050513  0.000000      2.000000
 -0.052494 -0.010103  0.000000      2.000000
  0.069992 -0.020205  0.000000      2.000000
  0.052494  0.050513  0.000000      2.000000
 -0.017498  0.070718  0.000000      2.000000
  0.052494 -0.050513  0.000000      2.000000
 -0.017498 -0.070718  0.000000      2.000000
 -0.069992 -0.020205  0.000000      2.000000
  0.087490 -0.030308  0.000000      2.000000
  0.069992  0.060615  0.000000      2.000000
 -0.017498  0.090923  0.000000      2.000000
  0.069992 -0.060615  0.000000      2.000000
 -0.017498 -0.090923  0.000000      2.000000
 -0.087490 -0.030308  0.000000      2.000000
  0.104988 -0.040410  0.000000      2.000000
  0.087490  0.070718  0.000000      2.000000
 -0.017498  0.111128  0.000000      2.000000
  0.087490 -0.070718  0.000000      2.000000
 -0.017498 -0.111128  0.000000      2.000000
 -0.104988 -0.040410  0.000000      2.000000
  0.122486 -0.050513  0.000000      2.000000
  0.104988  0.080820  0.000000      2.000000
 -0.017498  0.131333  0.000000      2.000000
  0.104988 -0.080820  0.000000      2.000000
 -0.017498 -0.131333  0.000000      2.000000
 -0.122486 -0.050513  0.000000      2.000000
  0.139984 -0.060615  0.000000      2.000000
  0.122486  0.090923  0.000000      2.000000
 -0.017498  0.151538  0.000000      2.000000
  0.122486 -0.090923  0.000000      2.000000
 -0.017498 -0.151538  0.000000      2.000000
 -0.139984 -0.060615  0.000000      2.000000
  0.157483 -0.070718  0.000000      2.000000
  0.139984  0.101025  0.000000      2.000000
 -0.017498  0.171743  0.000000      2.000000
  0.139984 -0.101025  0.000000      2.000000
 -0.017498 -0.171743  0.000000      2.000000
 -0.157483 -0.070718  0.000000      2.000000
  0.174981 -0.080820  0.000000      2.000000
  0.157483  0.111128  0.000000      2.000000
 -0.017498  0.191948  0.000000      2.000000
  0.157483 -0.111128  0.000000      2.000000
 -0.017498  0.212153  0.000000      2.000000
  0.174981 -0.282870  0.000000      2.000000
  0.069992  0.000000  0.000000      2.000000
  0.034996  0.060615  0.000000      2.000000
 -0.034996  0.060615  0.000000      2.000000
  0.087490 -0.010103  0.000000      2.000000
  0.052494  0.070718  0.000000      2.000000
 -0.034996  0.080820  0.000000      2.000000
  0.052494 -0.070718  0.000000      2.000000
 -0.034996 -0.080820  0.000000      2.000000
 -0.087490 -0.010103  0.000000      2.000000
  0.104988 -0.020205  0.000000      2.000000
  0.069992  0.080820  0.000000      2.000000
 -0.034996  0.101025  0.000000      2.000000
  0.069992 -0.080820  0.000000      2.000000
 -0.034996 -0.101025  0.000000      2.000000
 -0.104988 -0.020205  0.000000      2.000000
  0.122486 -0.030308  0.000000      2.000000
  0.087490  0.090923  0.000000      2.000000
 -0.034996  0.121230  0.000000      2.000000
  0.087490 -0.090923  0.000000      2.000000
 -0.034996 -0.121230  0.000000      2.000000
 -0.122486 -0.030308  0.000000      2.000000
  0.139984 -0.040410  0.000000      2.000000
  0.104988  0.101025  0.000000      2.000000
 -0.034996  0.141435  0.000000      2.000000
  0.104988 -0.101025  0.000000      2.000000
 -0.034996 -0.141435  0.000000      2.000000
 -0.139984 -0.040410  0.000000      2.000000
  0.157483 -0.050513  0.000000      2.000000
  0.122486  0.111128  0.000000      2.000000
 -0.034996  0.161640  0.000000      2.000000
  0.122486 -0.111128  0.000000      2.000000
 -0.034996 -0.161640  0.000000      2.000000
 -0.157483 -0.050513  0.000000      2.000000
  0.174981 -0.060615  0.000000      2.000000
  0.139984  0.121230  0.000000      2.000000
 -0.034996  0.181845  0.000000      2.000000
  0.139984 -0.121230  0.000000      2.000000
 -0.034996  0.222255  0.000000      2.000000
  0.174981 -0.262665  0.000000      2.000000
 -0.157483  0.131333  0.000000      2.000000
  0.157483 -0.272768  0.000000      2.000000
 -0.034996  0.202050  0.000000      2.000000
  0.104988  0.000000  0.000000      2.000000
  0.052494  0.090923  0.000000      2.000000
 -0.052494  0.090923  0.000000      2.000000
  0.122486 -0.010103  0.000000      2.000000
  0.069992  0.101025  0.000000      2.000000
 -0.052494  0.111128  0.000000      2.000000
  0.069992 -0.101025  0.000000      2.000000
 -0.052494 -0.111128  0.000000      2.000000
 -0.122486 -0.010103  0.000000      2.000000
  0.139984 -0.020205  0.000000      2.000000
  0.087490  0.111128  0.000000      2.000000
 -0.052494  0.131333  0.000000      2.000000
  0.087490 -0.111128  0.000000      2.000000
 -0.052494 -0.131333  0.000000      2.000000
 -0.139984 -0.020205  0.000000      2.000000
  0.157483 -0.030308  0.000000      2.000000
  0.104988  0.121230  0.000000      2.000000
 -0.052494  0.151538  0.000000      2.000000
  0.104988 -0.121230  0.000000      2.000000
 -0.052494 -0.151538  0.000000      2.000000
 -0.157483 -0.030308  0.000000      2.000000
  0.174981 -0.040410  0.000000      2.000000
  0.122486  0.131333  0.000000      2.000000
 -0.052494  0.171743  0.000000      2.000000
  0.122486 -0.131333  0.000000      2.000000
 -0.052494  0.232358  0.000000      2.000000
  0.174981 -0.242460  0.000000      2.000000
 -0.157483  0.151538  0.000000      2.000000
  0.139984 -0.262665  0.000000      2.000000
 -0.052494  0.191948  0.000000      2.000000
  0.139984 -0.141435  0.000000      2.000000
 -0.052494  0.212153  0.000000      2.000000
  0.157483 -0.252563  0.000000      2.000000
  0.139984  0.000000  0.000000      2.000000
  0.069992  0.121230  0.000000      2.000000
 -0.069992  0.121230  0.000000      2.000000
  0.157483 -0.010103  0.000000      2.000000
  0.087490  0.131333  0.000000      2.000000
 -0.069992  0.141435  0.000000      2.000000
  0.087490 -0.131333  0.000000      2.000000
 -0.069992 -0.141435  0.000000      2.000000
 -0.157483 -0.010103  0.000000      2.000000
  0.174981 -0.020205  0.000000      2.000000
  0.104988  0.141435  0.000000      2.000000
 -0.069992  0.161640  0.000000      2.000000
  0.104988 -0.141435  0.000000      2.000000
 -0.069992  0.242460  0.000000      2.000000
  0.174981 -0.222255  0.000000      2.000000
 -0.157483  0.171743  0.000000      2.000000
  0.122486 -0.252563  0.000000      2.000000
 -0.069992  0.181845  0.000000      2.000000
  0.122486 -0.151538  0.000000      2.000000
 -0.069992  0.222255  0.000000      2.000000
  0.157483 -0.232358  0.000000      2.000000
 -0.139984  0.161640  0.000000      2.000000
  0.139984 -0.242460  0.000000      2.000000
 -0.069992  0.202050  0.000000      2.000000
  0.174981  0.000000  0.000000      2.000000
  0.087490  0.151538  0.000000      2.000000
 -0.087490  0.151538  0.000000      2.000000
 -0.157483  0.191948  0.000000      2.000000
  0.104988 -0.242460  0.000000      2.000000
 -0.087490  0.171743  0.000000      2.000000
  0.104988 -0.161640  0.000000      2.000000
 -0.087490  0.232358  0.000000      2.000000
  0.157483 -0.212153  0.000000      2.000000
 -0.139984  0.181845  0.000000      2.000000
  0.122486 -0.232358  0.000000      2.000000
 -0.087490  0.191948  0.000000      2.000000
  0.122486 -0.171743  0.000000      2.000000
 -0.087490  0.212153  0.000000      2.000000
  0.139984 -0.222255  0.000000      2.000000
 -0.139984  0.202050  0.000000      2.000000
  0.104988 -0.222255  0.000000      2.000000
 -0.104988  0.181845  0.000000      2.000000
 -0.122486  0.191948  0.000000      2.000000
  0.122486 -0.212153  0.000000      2.000000
 -0.104988  0.202050  0.000000      2.000000
 
 
 Subroutine IBZKPT_HF returns following result:
 ==============================================
 
 Found    400 k-points in 1st BZ
 the following    400 k-points will be used (e.g. in the exchange kernel)
 Following reciprocal coordinates:   # in IRBZ
  0.000000  0.000000  0.000000    0.00250000   1 t-inv F
  0.050000 -0.000000  0.000000    0.00250000   2 t-inv F
  0.050000  0.050000  0.000000    0.00250000   3 t-inv F
  0.000000  0.050000  0.000000    0.00250000   4 t-inv F
  0.100000  0.000000  0.000000    0.00250000   5 t-inv F
  0.100000  0.100000  0.000000    0.00250000   6 t-inv F
  0.000000  0.100000  0.000000    0.00250000   7 t-inv F
  0.150000 -0.000000  0.000000    0.00250000   8 t-inv F
  0.150000  0.150000  0.000000    0.00250000   9 t-inv F
  0.000000  0.150000  0.000000    0.00250000  10 t-inv F
  0.200000  0.000000  0.000000    0.00250000  11 t-inv F
  0.200000  0.200000  0.000000    0.00250000  12 t-inv F
  0.000000  0.200000  0.000000    0.00250000  13 t-inv F
  0.250000 -0.000000  0.000000    0.00250000  14 t-inv F
  0.250000  0.250000  0.000000    0.00250000  15 t-inv F
  0.000000  0.250000  0.000000    0.00250000  16 t-inv F
  0.300000 -0.000000  0.000000    0.00250000  17 t-inv F
  0.300000  0.300000  0.000000    0.00250000  18 t-inv F
  0.000000  0.300000  0.000000    0.00250000  19 t-inv F
  0.350000  0.000000  0.000000    0.00250000  20 t-inv F
  0.350000  0.350000  0.000000    0.00250000  21 t-inv F
  0.000000  0.350000  0.000000    0.00250000  22 t-inv F
  0.400000 -0.000000  0.000000    0.00250000  23 t-inv F
  0.400000  0.400000  0.000000    0.00250000  24 t-inv F
  0.000000  0.400000  0.000000    0.00250000  25 t-inv F
  0.450000 -0.000000  0.000000    0.00250000  26 t-inv F
  0.450000  0.450000  0.000000    0.00250000  27 t-inv F
  0.000000  0.450000  0.000000    0.00250000  28 t-inv F
  0.500000 -0.000000  0.000000    0.00250000  29 t-inv F
  0.500000  0.500000  0.000000    0.00250000  30 t-inv F
  0.000000  0.500000  0.000000    0.00250000  31 t-inv F
  0.100000  0.050000  0.000000    0.00250000  32 t-inv F
  0.050000  0.100000  0.000000    0.00250000  33 t-inv F
 -0.050000  0.050000  0.000000    0.00250000  34 t-inv F
  0.150000  0.050000  0.000000    0.00250000  35 t-inv F
  0.100000  0.150000  0.000000    0.00250000  36 t-inv F
 -0.050000  0.100000  0.000000    0.00250000  37 t-inv F
  0.100000 -0.050000  0.000000    0.00250000  38 t-inv F
 -0.050000 -0.150000  0.000000    0.00250000  39 t-inv F
 -0.150000 -0.100000  0.000000    0.00250000  40 t-inv F
  0.200000  0.050000  0.000000    0.00250000  41 t-inv F
  0.150000  0.200000  0.000000    0.00250000  42 t-inv F
 -0.050000  0.150000  0.000000    0.00250000  43 t-inv F
  0.150000 -0.050000  0.000000    0.00250000  44 t-inv F
 -0.050000 -0.200000  0.000000    0.00250000  45 t-inv F
 -0.200000 -0.150000  0.000000    0.00250000  46 t-inv F
  0.250000  0.050000  0.000000    0.00250000  47 t-inv F
  0.200000  0.250000  0.000000    0.00250000  48 t-inv F
 -0.050000  0.200000  0.000000    0.00250000  49 t-inv F
  0.200000 -0.050000  0.000000    0.00250000  50 t-inv F
 -0.050000 -0.250000  0.000000    0.00250000  51 t-inv F
 -0.250000 -0.200000  0.000000    0.00250000  52 t-inv F
  0.300000  0.050000  0.000000    0.00250000  53 t-inv F
  0.250000  0.300000  0.000000    0.00250000  54 t-inv F
 -0.050000  0.250000  0.000000    0.00250000  55 t-inv F
  0.250000 -0.050000  0.000000    0.00250000  56 t-inv F
 -0.050000 -0.300000  0.000000    0.00250000  57 t-inv F
 -0.300000 -0.250000  0.000000    0.00250000  58 t-inv F
  0.350000  0.050000  0.000000    0.00250000  59 t-inv F
  0.300000  0.350000  0.000000    0.00250000  60 t-inv F
 -0.050000  0.300000  0.000000    0.00250000  61 t-inv F
  0.300000 -0.050000  0.000000    0.00250000  62 t-inv F
 -0.050000 -0.350000  0.000000    0.00250000  63 t-inv F
 -0.350000 -0.300000  0.000000    0.00250000  64 t-inv F
  0.400000  0.050000  0.000000    0.00250000  65 t-inv F
  0.350000  0.400000  0.000000    0.00250000  66 t-inv F
 -0.050000  0.350000  0.000000    0.00250000  67 t-inv F
  0.350000 -0.050000  0.000000    0.00250000  68 t-inv F
 -0.050000 -0.400000  0.000000    0.00250000  69 t-inv F
 -0.400000 -0.350000  0.000000    0.00250000  70 t-inv F
  0.450000  0.050000  0.000000    0.00250000  71 t-inv F
  0.400000  0.450000  0.000000    0.00250000  72 t-inv F
 -0.050000  0.400000  0.000000    0.00250000  73 t-inv F
  0.400000 -0.050000  0.000000    0.00250000  74 t-inv F
 -0.050000 -0.450000  0.000000    0.00250000  75 t-inv F
 -0.450000 -0.400000  0.000000    0.00250000  76 t-inv F
  0.500000  0.050000  0.000000    0.00250000  77 t-inv F
  0.450000  0.500000  0.000000    0.00250000  78 t-inv F
 -0.050000  0.450000  0.000000    0.00250000  79 t-inv F
  0.450000 -0.050000  0.000000    0.00250000  80 t-inv F
 -0.050000  0.500000  0.000000    0.00250000  81 t-inv F
  0.500000 -0.450000  0.000000    0.00250000  82 t-inv F
  0.200000  0.100000  0.000000    0.00250000  83 t-inv F
  0.100000  0.200000  0.000000    0.00250000  84 t-inv F
 -0.100000  0.100000  0.000000    0.00250000  85 t-inv F
  0.250000  0.100000  0.000000    0.00250000  86 t-inv F
  0.150000  0.250000  0.000000    0.00250000  87 t-inv F
 -0.100000  0.150000  0.000000    0.00250000  88 t-inv F
  0.150000 -0.100000  0.000000    0.00250000  89 t-inv F
 -0.100000 -0.250000  0.000000    0.00250000  90 t-inv F
 -0.250000 -0.150000  0.000000    0.00250000  91 t-inv F
  0.300000  0.100000  0.000000    0.00250000  92 t-inv F
  0.200000  0.300000  0.000000    0.00250000  93 t-inv F
 -0.100000  0.200000  0.000000    0.00250000  94 t-inv F
  0.200000 -0.100000  0.000000    0.00250000  95 t-inv F
 -0.100000 -0.300000  0.000000    0.00250000  96 t-inv F
 -0.300000 -0.200000  0.000000    0.00250000  97 t-inv F
  0.350000  0.100000  0.000000    0.00250000  98 t-inv F
  0.250000  0.350000  0.000000    0.00250000  99 t-inv F
 -0.100000  0.250000  0.000000    0.00250000 100 t-inv F
  0.250000 -0.100000  0.000000    0.00250000 101 t-inv F
 -0.100000 -0.350000  0.000000    0.00250000 102 t-inv F
 -0.350000 -0.250000  0.000000    0.00250000 103 t-inv F
  0.400000  0.100000  0.000000    0.00250000 104 t-inv F
  0.300000  0.400000  0.000000    0.00250000 105 t-inv F
 -0.100000  0.300000  0.000000    0.00250000 106 t-inv F
  0.300000 -0.100000  0.000000    0.00250000 107 t-inv F
 -0.100000 -0.400000  0.000000    0.00250000 108 t-inv F
 -0.400000 -0.300000  0.000000    0.00250000 109 t-inv F
  0.450000  0.100000  0.000000    0.00250000 110 t-inv F
  0.350000  0.450000  0.000000    0.00250000 111 t-inv F
 -0.100000  0.350000  0.000000    0.00250000 112 t-inv F
  0.350000 -0.100000  0.000000    0.00250000 113 t-inv F
 -0.100000 -0.450000  0.000000    0.00250000 114 t-inv F
 -0.450000 -0.350000  0.000000    0.00250000 115 t-inv F
  0.500000  0.100000  0.000000    0.00250000 116 t-inv F
  0.400000  0.500000  0.000000    0.00250000 117 t-inv F
 -0.100000  0.400000  0.000000    0.00250000 118 t-inv F
  0.400000 -0.100000  0.000000    0.00250000 119 t-inv F
 -0.100000  0.500000  0.000000    0.00250000 120 t-inv F
  0.500000 -0.400000  0.000000    0.00250000 121 t-inv F
 -0.450000  0.100000  0.000000    0.00250000 122 t-inv F
  0.450000 -0.450000  0.000000    0.00250000 123 t-inv F
 -0.100000  0.450000  0.000000    0.00250000 124 t-inv F
  0.300000  0.150000  0.000000    0.00250000 125 t-inv F
  0.150000  0.300000  0.000000    0.00250000 126 t-inv F
 -0.150000  0.150000  0.000000    0.00250000 127 t-inv F
  0.350000  0.150000  0.000000    0.00250000 128 t-inv F
  0.200000  0.350000  0.000000    0.00250000 129 t-inv F
 -0.150000  0.200000  0.000000    0.00250000 130 t-inv F
  0.200000 -0.150000  0.000000    0.00250000 131 t-inv F
 -0.150000 -0.350000  0.000000    0.00250000 132 t-inv F
 -0.350000 -0.200000  0.000000    0.00250000 133 t-inv F
  0.400000  0.150000  0.000000    0.00250000 134 t-inv F
  0.250000  0.400000  0.000000    0.00250000 135 t-inv F
 -0.150000  0.250000  0.000000    0.00250000 136 t-inv F
  0.250000 -0.150000  0.000000    0.00250000 137 t-inv F
 -0.150000 -0.400000  0.000000    0.00250000 138 t-inv F
 -0.400000 -0.250000  0.000000    0.00250000 139 t-inv F
  0.450000  0.150000  0.000000    0.00250000 140 t-inv F
  0.300000  0.450000  0.000000    0.00250000 141 t-inv F
 -0.150000  0.300000  0.000000    0.00250000 142 t-inv F
  0.300000 -0.150000  0.000000    0.00250000 143 t-inv F
 -0.150000 -0.450000  0.000000    0.00250000 144 t-inv F
 -0.450000 -0.300000  0.000000    0.00250000 145 t-inv F
  0.500000  0.150000  0.000000    0.00250000 146 t-inv F
  0.350000  0.500000  0.000000    0.00250000 147 t-inv F
 -0.150000  0.350000  0.000000    0.00250000 148 t-inv F
  0.350000 -0.150000  0.000000    0.00250000 149 t-inv F
 -0.150000  0.500000  0.000000    0.00250000 150 t-inv F
  0.500000 -0.350000  0.000000    0.00250000 151 t-inv F
 -0.450000  0.150000  0.000000    0.00250000 152 t-inv F
  0.400000 -0.450000  0.000000    0.00250000 153 t-inv F
 -0.150000  0.400000  0.000000    0.00250000 154 t-inv F
  0.400000 -0.150000  0.000000    0.00250000 155 t-inv F
 -0.150000  0.450000  0.000000    0.00250000 156 t-inv F
  0.450000 -0.400000  0.000000    0.00250000 157 t-inv F
  0.400000  0.200000  0.000000    0.00250000 158 t-inv F
  0.200000  0.400000  0.000000    0.00250000 159 t-inv F
 -0.200000  0.200000  0.000000    0.00250000 160 t-inv F
  0.450000  0.200000  0.000000    0.00250000 161 t-inv F
  0.250000  0.450000  0.000000    0.00250000 162 t-inv F
 -0.200000  0.250000  0.000000    0.00250000 163 t-inv F
  0.250000 -0.200000  0.000000    0.00250000 164 t-inv F
 -0.200000 -0.450000  0.000000    0.00250000 165 t-inv F
 -0.450000 -0.250000  0.000000    0.00250000 166 t-inv F
  0.500000  0.200000  0.000000    0.00250000 167 t-inv F
  0.300000  0.500000  0.000000    0.00250000 168 t-inv F
 -0.200000  0.300000  0.000000    0.00250000 169 t-inv F
  0.300000 -0.200000  0.000000    0.00250000 170 t-inv F
 -0.200000  0.500000  0.000000    0.00250000 171 t-inv F
  0.500000 -0.300000  0.000000    0.00250000 172 t-inv F
 -0.450000  0.200000  0.000000    0.00250000 173 t-inv F
  0.350000 -0.450000  0.000000    0.00250000 174 t-inv F
 -0.200000  0.350000  0.000000    0.00250000 175 t-inv F
  0.350000 -0.200000  0.000000    0.00250000 176 t-inv F
 -0.200000  0.450000  0.000000    0.00250000 177 t-inv F
  0.450000 -0.350000  0.000000    0.00250000 178 t-inv F
 -0.400000  0.200000  0.000000    0.00250000 179 t-inv F
  0.400000 -0.400000  0.000000    0.00250000 180 t-inv F
 -0.200000  0.400000  0.000000    0.00250000 181 t-inv F
  0.500000  0.250000  0.000000    0.00250000 182 t-inv F
  0.250000  0.500000  0.000000    0.00250000 183 t-inv F
 -0.250000  0.250000  0.000000    0.00250000 184 t-inv F
 -0.450000  0.250000  0.000000    0.00250000 185 t-inv F
  0.300000 -0.450000  0.000000    0.00250000 186 t-inv F
 -0.250000  0.300000  0.000000    0.00250000 187 t-inv F
  0.300000 -0.250000  0.000000    0.00250000 188 t-inv F
 -0.250000  0.450000  0.000000    0.00250000 189 t-inv F
  0.450000 -0.300000  0.000000    0.00250000 190 t-inv F
 -0.400000  0.250000  0.000000    0.00250000 191 t-inv F
  0.350000 -0.400000  0.000000    0.00250000 192 t-inv F
 -0.250000  0.350000  0.000000    0.00250000 193 t-inv F
  0.350000 -0.250000  0.000000    0.00250000 194 t-inv F
 -0.250000  0.400000  0.000000    0.00250000 195 t-inv F
  0.400000 -0.350000  0.000000    0.00250000 196 t-inv F
 -0.400000  0.300000  0.000000    0.00250000 197 t-inv F
  0.300000 -0.400000  0.000000    0.00250000 198 t-inv F
 -0.300000  0.300000  0.000000    0.00250000 199 t-inv F
 -0.350000  0.300000  0.000000    0.00250000 200 t-inv F
  0.350000 -0.350000  0.000000    0.00250000 201 t-inv F
 -0.300000  0.350000  0.000000    0.00250000 202 t-inv F
 -0.050000  0.000000  0.000000    0.00250000   2 t-inv T
 -0.050000 -0.050000  0.000000    0.00250000   3 t-inv T
  0.000000 -0.050000  0.000000    0.00250000   4 t-inv T
 -0.100000 -0.000000  0.000000    0.00250000   5 t-inv T
 -0.100000 -0.100000  0.000000    0.00250000   6 t-inv T
  0.000000 -0.100000  0.000000    0.00250000   7 t-inv T
 -0.150000  0.000000  0.000000    0.00250000   8 t-inv T
 -0.150000 -0.150000  0.000000    0.00250000   9 t-inv T
  0.000000 -0.150000  0.000000    0.00250000  10 t-inv T
 -0.200000 -0.000000  0.000000    0.00250000  11 t-inv T
 -0.200000 -0.200000  0.000000    0.00250000  12 t-inv T
  0.000000 -0.200000  0.000000    0.00250000  13 t-inv T
 -0.250000  0.000000  0.000000    0.00250000  14 t-inv T
 -0.250000 -0.250000  0.000000    0.00250000  15 t-inv T
  0.000000 -0.250000  0.000000    0.00250000  16 t-inv T
 -0.300000  0.000000  0.000000    0.00250000  17 t-inv T
 -0.300000 -0.300000  0.000000    0.00250000  18 t-inv T
  0.000000 -0.300000  0.000000    0.00250000  19 t-inv T
 -0.350000 -0.000000  0.000000    0.00250000  20 t-inv T
 -0.350000 -0.350000  0.000000    0.00250000  21 t-inv T
  0.000000 -0.350000  0.000000    0.00250000  22 t-inv T
 -0.400000  0.000000  0.000000    0.00250000  23 t-inv T
 -0.400000 -0.400000  0.000000    0.00250000  24 t-inv T
  0.000000 -0.400000  0.000000    0.00250000  25 t-inv T
 -0.450000  0.000000  0.000000    0.00250000  26 t-inv T
 -0.450000 -0.450000  0.000000    0.00250000  27 t-inv T
  0.000000 -0.450000  0.000000    0.00250000  28 t-inv T
 -0.100000 -0.050000  0.000000    0.00250000  32 t-inv T
 -0.050000 -0.100000  0.000000    0.00250000  33 t-inv T
  0.050000 -0.050000  0.000000    0.00250000  34 t-inv T
 -0.150000 -0.050000  0.000000    0.00250000  35 t-inv T
 -0.100000 -0.150000  0.000000    0.00250000  36 t-inv T
  0.050000 -0.100000  0.000000    0.00250000  37 t-inv T
 -0.100000  0.050000  0.000000    0.00250000  38 t-inv T
  0.050000  0.150000  0.000000    0.00250000  39 t-inv T
  0.150000  0.100000  0.000000    0.00250000  40 t-inv T
 -0.200000 -0.050000  0.000000    0.00250000  41 t-inv T
 -0.150000 -0.200000  0.000000    0.00250000  42 t-inv T
  0.050000 -0.150000  0.000000    0.00250000  43 t-inv T
 -0.150000  0.050000  0.000000    0.00250000  44 t-inv T
  0.050000  0.200000  0.000000    0.00250000  45 t-inv T
  0.200000  0.150000  0.000000    0.00250000  46 t-inv T
 -0.250000 -0.050000  0.000000    0.00250000  47 t-inv T
 -0.200000 -0.250000  0.000000    0.00250000  48 t-inv T
  0.050000 -0.200000  0.000000    0.00250000  49 t-inv T
 -0.200000  0.050000  0.000000    0.00250000  50 t-inv T
  0.050000  0.250000  0.000000    0.00250000  51 t-inv T
  0.250000  0.200000  0.000000    0.00250000  52 t-inv T
 -0.300000 -0.050000  0.000000    0.00250000  53 t-inv T
 -0.250000 -0.300000  0.000000    0.00250000  54 t-inv T
  0.050000 -0.250000  0.000000    0.00250000  55 t-inv T
 -0.250000  0.050000  0.000000    0.00250000  56 t-inv T
  0.050000  0.300000  0.000000    0.00250000  57 t-inv T
  0.300000  0.250000  0.000000    0.00250000  58 t-inv T
 -0.350000 -0.050000  0.000000    0.00250000  59 t-inv T
 -0.300000 -0.350000  0.000000    0.00250000  60 t-inv T
  0.050000 -0.300000  0.000000    0.00250000  61 t-inv T
 -0.300000  0.050000  0.000000    0.00250000  62 t-inv T
  0.050000  0.350000  0.000000    0.00250000  63 t-inv T
  0.350000  0.300000  0.000000    0.00250000  64 t-inv T
 -0.400000 -0.050000  0.000000    0.00250000  65 t-inv T
 -0.350000 -0.400000  0.000000    0.00250000  66 t-inv T
  0.050000 -0.350000  0.000000    0.00250000  67 t-inv T
 -0.350000  0.050000  0.000000    0.00250000  68 t-inv T
  0.050000  0.400000  0.000000    0.00250000  69 t-inv T
  0.400000  0.350000  0.000000    0.00250000  70 t-inv T
 -0.450000 -0.050000  0.000000    0.00250000  71 t-inv T
 -0.400000 -0.450000  0.000000    0.00250000  72 t-inv T
  0.050000 -0.400000  0.000000    0.00250000  73 t-inv T
 -0.400000  0.050000  0.000000    0.00250000  74 t-inv T
  0.050000  0.450000  0.000000    0.00250000  75 t-inv T
  0.450000  0.400000  0.000000    0.00250000  76 t-inv T
 -0.500000 -0.050000  0.000000    0.00250000  77 t-inv T
 -0.450000 -0.500000  0.000000    0.00250000  78 t-inv T
  0.050000 -0.450000  0.000000    0.00250000  79 t-inv T
 -0.450000  0.050000  0.000000    0.00250000  80 t-inv T
  0.050000 -0.500000  0.000000    0.00250000  81 t-inv T
 -0.500000  0.450000  0.000000    0.00250000  82 t-inv T
 -0.200000 -0.100000  0.000000    0.00250000  83 t-inv T
 -0.100000 -0.200000  0.000000    0.00250000  84 t-inv T
  0.100000 -0.100000  0.000000    0.00250000  85 t-inv T
 -0.250000 -0.100000  0.000000    0.00250000  86 t-inv T
 -0.150000 -0.250000  0.000000    0.00250000  87 t-inv T
  0.100000 -0.150000  0.000000    0.00250000  88 t-inv T
 -0.150000  0.100000  0.000000    0.00250000  89 t-inv T
  0.100000  0.250000  0.000000    0.00250000  90 t-inv T
  0.250000  0.150000  0.000000    0.00250000  91 t-inv T
 -0.300000 -0.100000  0.000000    0.00250000  92 t-inv T
 -0.200000 -0.300000  0.000000    0.00250000  93 t-inv T
  0.100000 -0.200000  0.000000    0.00250000  94 t-inv T
 -0.200000  0.100000  0.000000    0.00250000  95 t-inv T
  0.100000  0.300000  0.000000    0.00250000  96 t-inv T
  0.300000  0.200000  0.000000    0.00250000  97 t-inv T
 -0.350000 -0.100000  0.000000    0.00250000  98 t-inv T
 -0.250000 -0.350000  0.000000    0.00250000  99 t-inv T
  0.100000 -0.250000  0.000000    0.00250000 100 t-inv T
 -0.250000  0.100000  0.000000    0.00250000 101 t-inv T
  0.100000  0.350000  0.000000    0.00250000 102 t-inv T
  0.350000  0.250000  0.000000    0.00250000 103 t-inv T
 -0.400000 -0.100000  0.000000    0.00250000 104 t-inv T
 -0.300000 -0.400000  0.000000    0.00250000 105 t-inv T
  0.100000 -0.300000  0.000000    0.00250000 106 t-inv T
 -0.300000  0.100000  0.000000    0.00250000 107 t-inv T
  0.100000  0.400000  0.000000    0.00250000 108 t-inv T
  0.400000  0.300000  0.000000    0.00250000 109 t-inv T
 -0.450000 -0.100000  0.000000    0.00250000 110 t-inv T
 -0.350000 -0.450000  0.000000    0.00250000 111 t-inv T
  0.100000 -0.350000  0.000000    0.00250000 112 t-inv T
 -0.350000  0.100000  0.000000    0.00250000 113 t-inv T
  0.100000  0.450000  0.000000    0.00250000 114 t-inv T
  0.450000  0.350000  0.000000    0.00250000 115 t-inv T
 -0.500000 -0.100000  0.000000    0.00250000 116 t-inv T
 -0.400000 -0.500000  0.000000    0.00250000 117 t-inv T
  0.100000 -0.400000  0.000000    0.00250000 118 t-inv T
 -0.400000  0.100000  0.000000    0.00250000 119 t-inv T
  0.100000 -0.500000  0.000000    0.00250000 120 t-inv T
 -0.500000  0.400000  0.000000    0.00250000 121 t-inv T
  0.450000 -0.100000  0.000000    0.00250000 122 t-inv T
 -0.450000  0.450000  0.000000    0.00250000 123 t-inv T
  0.100000 -0.450000  0.000000    0.00250000 124 t-inv T
 -0.300000 -0.150000  0.000000    0.00250000 125 t-inv T
 -0.150000 -0.300000  0.000000    0.00250000 126 t-inv T
  0.150000 -0.150000  0.000000    0.00250000 127 t-inv T
 -0.350000 -0.150000  0.000000    0.00250000 128 t-inv T
 -0.200000 -0.350000  0.000000    0.00250000 129 t-inv T
  0.150000 -0.200000  0.000000    0.00250000 130 t-inv T
 -0.200000  0.150000  0.000000    0.00250000 131 t-inv T
  0.150000  0.350000  0.000000    0.00250000 132 t-inv T
  0.350000  0.200000  0.000000    0.00250000 133 t-inv T
 -0.400000 -0.150000  0.000000    0.00250000 134 t-inv T
 -0.250000 -0.400000  0.000000    0.00250000 135 t-inv T
  0.150000 -0.250000  0.000000    0.00250000 136 t-inv T
 -0.250000  0.150000  0.000000    0.00250000 137 t-inv T
  0.150000  0.400000  0.000000    0.00250000 138 t-inv T
  0.400000  0.250000  0.000000    0.00250000 139 t-inv T
 -0.450000 -0.150000  0.000000    0.00250000 140 t-inv T
 -0.300000 -0.450000  0.000000    0.00250000 141 t-inv T
  0.150000 -0.300000  0.000000    0.00250000 142 t-inv T
 -0.300000  0.150000  0.000000    0.00250000 143 t-inv T
  0.150000  0.450000  0.000000    0.00250000 144 t-inv T
  0.450000  0.300000  0.000000    0.00250000 145 t-inv T
 -0.500000 -0.150000  0.000000    0.00250000 146 t-inv T
 -0.350000 -0.500000  0.000000    0.00250000 147 t-inv T
  0.150000 -0.350000  0.000000    0.00250000 148 t-inv T
 -0.350000  0.150000  0.000000    0.00250000 149 t-inv T
  0.150000 -0.500000  0.000000    0.00250000 150 t-inv T
 -0.500000  0.350000  0.000000    0.00250000 151 t-inv T
  0.450000 -0.150000  0.000000    0.00250000 152 t-inv T
 -0.400000  0.450000  0.000000    0.00250000 153 t-inv T
  0.150000 -0.400000  0.000000    0.00250000 154 t-inv T
 -0.400000  0.150000  0.000000    0.00250000 155 t-inv T
  0.150000 -0.450000  0.000000    0.00250000 156 t-inv T
 -0.450000  0.400000  0.000000    0.00250000 157 t-inv T
 -0.400000 -0.200000  0.000000    0.00250000 158 t-inv T
 -0.200000 -0.400000  0.000000    0.00250000 159 t-inv T
  0.200000 -0.200000  0.000000    0.00250000 160 t-inv T
 -0.450000 -0.200000  0.000000    0.00250000 161 t-inv T
 -0.250000 -0.450000  0.000000    0.00250000 162 t-inv T
  0.200000 -0.250000  0.000000    0.00250000 163 t-inv T
 -0.250000  0.200000  0.000000    0.00250000 164 t-inv T
  0.200000  0.450000  0.000000    0.00250000 165 t-inv T
  0.450000  0.250000  0.000000    0.00250000 166 t-inv T
 -0.500000 -0.200000  0.000000    0.00250000 167 t-inv T
 -0.300000 -0.500000  0.000000    0.00250000 168 t-inv T
  0.200000 -0.300000  0.000000    0.00250000 169 t-inv T
 -0.300000  0.200000  0.000000    0.00250000 170 t-inv T
  0.200000 -0.500000  0.000000    0.00250000 171 t-inv T
 -0.500000  0.300000  0.000000    0.00250000 172 t-inv T
  0.450000 -0.200000  0.000000    0.00250000 173 t-inv T
 -0.350000  0.450000  0.000000    0.00250000 174 t-inv T
  0.200000 -0.350000  0.000000    0.00250000 175 t-inv T
 -0.350000  0.200000  0.000000    0.00250000 176 t-inv T
  0.200000 -0.450000  0.000000    0.00250000 177 t-inv T
 -0.450000  0.350000  0.000000    0.00250000 178 t-inv T
  0.400000 -0.200000  0.000000    0.00250000 179 t-inv T
 -0.400000  0.400000  0.000000    0.00250000 180 t-inv T
  0.200000 -0.400000  0.000000    0.00250000 181 t-inv T
 -0.500000 -0.250000  0.000000    0.00250000 182 t-inv T
 -0.250000 -0.500000  0.000000    0.00250000 183 t-inv T
  0.250000 -0.250000  0.000000    0.00250000 184 t-inv T
  0.450000 -0.250000  0.000000    0.00250000 185 t-inv T
 -0.300000  0.450000  0.000000    0.00250000 186 t-inv T
  0.250000 -0.300000  0.000000    0.00250000 187 t-inv T
 -0.300000  0.250000  0.000000    0.00250000 188 t-inv T
  0.250000 -0.450000  0.000000    0.00250000 189 t-inv T
 -0.450000  0.300000  0.000000    0.00250000 190 t-inv T
  0.400000 -0.250000  0.000000    0.00250000 191 t-inv T
 -0.350000  0.400000  0.000000    0.00250000 192 t-inv T
  0.250000 -0.350000  0.000000    0.00250000 193 t-inv T
 -0.350000  0.250000  0.000000    0.00250000 194 t-inv T
  0.250000 -0.400000  0.000000    0.00250000 195 t-inv T
 -0.400000  0.350000  0.000000    0.00250000 196 t-inv T
  0.400000 -0.300000  0.000000    0.00250000 197 t-inv T
 -0.300000  0.400000  0.000000    0.00250000 198 t-inv T
  0.300000 -0.300000  0.000000    0.00250000 199 t-inv T
  0.350000 -0.300000  0.000000    0.00250000 200 t-inv T
 -0.350000  0.350000  0.000000    0.00250000 201 t-inv T
  0.300000 -0.350000  0.000000    0.00250000 202 t-inv T


--------------------------------------------------------------------------------------------------------




 Dimension of arrays:
   k-points           NKPTS =    202   k-points in BZ     NKDIM =    400   number of bands    NBANDS=     12
   number of dos      NEDOS =    301   number of ions     NIONS =      4
   non local maximal  LDIM  =      4   non local SUM 2l+1 LMDIM =      8
   total plane-waves  NPLWV =  44800
   max r-space proj   IRMAX =      1   max aug-charges    IRDMAX= 116228
   dimension x,y,z NGX =    20 NGY =   20 NGZ =  112
   dimension x,y,z NGXF=    40 NGYF=   40 NGZF=  224
   support grid    NGXF=    80 NGYF=   80 NGZF=  448
   ions per type =               4
   NGX,Y,Z   is equivalent  to a cutoff of  11.64, 11.64, 10.95 a.u.
   NGXF,Y,Z  is equivalent  to a cutoff of  23.27, 23.27, 21.91 a.u.

 SYSTEM =  Al Lattice Relaxation  HSE06-1/2x vdW-DF
 POSCAR =  Al                                      

 Startparameter for this run:
   NWRITE =      2    write-flag & timer
   PREC   = accura    normal or accurate (medium, high low for compatibility)
   ISTART =      1    job   : 0-new  1-cont  2-samecut
   ICHARG =      0    charge: 1-file 2-atom 10-const
   ISPIN  =      2    spin polarized calculation?
   LNONCOLLINEAR =      F non collinear calculations
   LSORBIT =      F    spin-orbit coupling
   INIWAV =      1    electr: 0-lowe 1-rand  2-diag
   LASPH  =      T    aspherical Exc in radial PAW
 Electronic Relaxation 1
   ENCUT  =  400.0 eV  29.40 Ry    5.42 a.u.   4.66  4.66 27.72*2*pi/ulx,y,z
   ENINI  =  400.0     initial cutoff
   ENAUG  =  291.1 eV  augmentation charge cutoff
   NELM   =    100;   NELMIN=  2; NELMDL=  0     # of ELM steps 
   EDIFF  = 0.1E-04   stopping-criterion for ELM
   LREAL  =      F    real-space projection
   NLSPLINE    = F    spline interpolate recip. space projectors
   LCOMPAT=      F    compatible to vasp.4.4
   GGA_COMPAT  = T    GGA compatible to vasp.4.4-vasp.4.6
   LMAXPAW     = -100 max onsite density
   LMAXMIX     =    2 max onsite mixed and CHGCAR
   VOSKOWN=      0    Vosko Wilk Nusair interpolation
   ROPT   =    0.00000
 Ionic relaxation
   EDIFFG = -.5E-02   stopping-criterion for IOM
   NSW    =    100    number of steps for IOM
   NBLOCK =      1;   KBLOCK =    100    inner block; outer block 
   IBRION =      1    ionic relax: 0-MD 1-quasi-New 2-CG
   NFREE  =      0    steps in history (QN), initial steepest desc. (CG)
   ISIF   =      0    stress and relaxation
   IWAVPR =     11    prediction:  0-non 1-charg 2-wave 3-comb
   ISYM   =      0    0-nonsym 1-usesym 2-fastsym
   LCORR  =      T    Harris-Foulkes like correction to forces

   POTIM  = 0.5000    time-step for ionic-motion
   TEIN   =    0.0    initial temperature
   TEBEG  =    0.0;   TEEND  =   0.0 temperature during run
   SMASS  =  -3.00    Nose mass-parameter (am)
   estimated Nose-frequenzy (Omega)   =  0.10E-29 period in steps = 0.13E+47 mass=  -0.187E-27a.u.
   SCALEE = 1.0000    scale energy and forces
   NPACO  =    256;   APACO  = 10.0  distance and # of slots for P.C.
   PSTRESS=    0.0 pullay stress

  Mass of Ions in am
   POMASS =  26.98
  Ionic Valenz
   ZVAL   =   3.00
  Atomic Wigner-Seitz radii
   RWIGS  =  -1.00
  virtual crystal weights 
   VCA    =   1.00
   NELECT =      12.0000    total number of electrons
   NUPDOWN=      -1.0000    fix difference up-down

 DOS related values:
   EMIN   =  10.00;   EMAX   =-10.00  energy-range for DOS
   EFERMI =   0.00
   ISMEAR =     1;   SIGMA  =   0.20  broadening in eV -4-tet -1-fermi 0-gaus

 Electronic relaxation 2 (details)
   IALGO  =     53    algorithm
   LDIAG  =      T    sub-space diagonalisation (order eigenvalues)
   LSUBROT=      F    optimize rotation matrix (better conditioning)
   TURBO    =      0    0=normal 1=particle mesh
   IRESTART =      0    0=no restart 2=restart with 2 vectors
   NREBOOT  =      0    no. of reboots
   NMIN     =      0    reboot dimension
   EREF     =   0.00    reference energy to select bands
   IMIX   =      4    mixing-type and parameters
     AMIX     =   0.40;   BMIX     =  1.00
     AMIX_MAG =   1.60;   BMIX_MAG =  1.00
     AMIN     =   0.10
     WC   =   100.;   INIMIX=   1;  MIXPRE=   1;  MAXMIX= -45

 Intra band minimization:
   WEIMIN = 0.0010     energy-eigenvalue tresh-hold
   EBREAK =  0.21E-06  absolut break condition
   DEPER  =   0.30     relativ break condition  

   TIME   =   0.20     timestep for ELM

  volume/ion in A,a.u.               =      30.05       202.80
  Fermi-wavevector in a.u.,A,eV,Ry     =   0.759442  1.435137  7.847184  0.576752
  Thomas-Fermi vector in A             =   1.858237
 
 Write flags
   LWAVE        =      T    write WAVECAR
   LDOWNSAMPLE  =      F    k-point downsampling of WAVECAR
   LCHARG       =      T    write CHGCAR
   LVTOT        =      F    write LOCPOT, total local potential
   LVHAR        =      F    write LOCPOT, Hartree potential only
   LELF         =      F    write electronic localiz. function (ELF)
   LORBIT       =      0    0 simple, 1 ext, 2 COOP (PROOUT), +10 PAW based schemes


 Dipole corrections
   LMONO  =      F    monopole corrections only (constant potential shift)
   LDIPOL =      F    correct potential (dipole corrections)
   IDIPOL =      0    1-x, 2-y, 3-z, 4-all directions 
   EPSILON=  1.0000000 bulk dielectric constant

 Exchange correlation treatment:
   GGA     =    PE    GGA type
   LEXCH   =     8    internal setting for exchange type
   LIBXC   =     F    Libxc                    
   VOSKOWN =     0    Vosko Wilk Nusair interpolation
   EXXOEP  =     0    0=HF, 1=EXX-LHF (local Hartree Fock) 2=EXX OEP
   LHFCALC =     T    Hartree Fock is set to
   LSYMGRAD=     F    symmetrize gradient (conserves proper symmetry)
   PRECFOCK=normal    Normal, Fast or Accurate (Low or Medium for compatibility)
   LRHFCALC=     F    long range Hartree Fock
   LRSCOR  =     F    long range correlation only (use DFT for short range part)
   LTHOMAS =     F    Thomas Fermi screening in HF
   LMODELHF=     F    short range full HF, long range fraction AEXX
   FOCKCORR=     1    mode to apply convergence corrections
   LFOCKACE=     T    use Adeptively-Compressed-Exchange operator
   ENCUT4O =  -1.0   cutoff for four orbital integrals eV
   LMAXFOCK=     4    L truncation for augmentation on plane wave grid
   LMAXFOCKAE=  -1    L truncation for all-electron charge restoration on plane wave grid
   NMAXFOCKAE=   1    number of basis functions for all-electron charge restoration
   LFOCKAEDFT=     F  apply the AE augmentation even for DFT
   NKREDX  =     1    reduce k-point grid by
   NKREDY  =     1    reduce k-point grid by
   NKREDZ  =     1    reduce k-point grid by
   SHIFTRED=     F    shift reduced grid of Gamma
   HFKIDENT=     F    idential grid for each k-point
   ODDONLY =     F    use only odd q-grid points
   EVENONLY=     F    use only even q-grid points
   HFALPHA =   -1.0000 decay constant for conv. correction
   MCALPHA =    0.0000 extent of test-charge in conv. correction in multipole expansion
   AEXX    =    0.5000 exact exchange contribution
   HFSCREEN=    0.2000 screening length (either q_TF or 0.3 A-1)
   HFSCREENC=   0.2000 screening length for correlation (either q_TF or 0.3 A-1)
   HFRCUT  =    0.0000 spherical cutoff for potential kernel
   ALDAX   =    0.5000 LDA exchange part
   AGGAX   =    0.5000 GGA exchange part
   ALDAC   =    1.0000 LDA correlation
   AGGAC   =    0.0000 GGA correlation
   ENCUTFOCK=  -1.0 apply spherical cutoff to Coloumb kernel
   NBANDSGWLOW=     1    first orbital included in HF term
   NBLOCK_FOCK=    64    blocking factor in FOCK_ACC

 vdW DFT:
   LUSE_VDW   =     T    switch on vdW DFT
   Zab_VDW    =******    correlation parameter
   PARAM1     =0.1234
   PARAM2     =1.0000
   PARAM3     =0.0000
   -- rVV10 --
   BPARAM     = 6.3000
   CPARAM     = 0.0093

 Linear response parameters
   LEPSILON=     F    determine dielectric tensor
   LRPA    =     F    only Hartree local field effects (RPA)
   LNABLA  =     F    use nabla operator in PAW spheres
   LVEL    =     F    velocity operator in full k-point grid
   CSHIFT  =0.1000    complex shift for real part using Kramers Kronig
   OMEGAMAX=  -1.0    maximum frequency
   DEG_THRESHOLD= 0.2000000E-02 threshold for treating states as degnerate
   RTIME   =   -0.100 relaxation time in fs
  (WPLASMAI=    0.000 imaginary part of plasma frequency in eV, 0.658/RTIME)
   DFIELD  = 0.0000000 0.0000000 0.0000000 field for delta impulse in time
 
  Optional k-point grid parameters
   LKPOINTS_OPT  =     F    use optional k-point grid
   KPOINTS_OPT_MODE=     1    mode for optional k-point grid
 
 Orbital magnetization related:
   ORBITALMAG=     F  switch on orbital magnetization
   LCHIMAG   =     F  perturbation theory with respect to B field
   DQ        =  0.001000  dq finite difference perturbation B field
   LLRAUG    =     F  two centre corrections for induced B field



--------------------------------------------------------------------------------------------------------


 quasi-Newton-method for relaxation of ions
   using selective dynamics as specified on POSCAR
   WARNING: If single coordinates had been selected the selection of coordinates
            is made according to the corresponding   d i r e c t   coordinates!
            Don't support selection of single cartesian coordinates -- sorry ...
  !
 charge density and potential will be updated during run
 spin polarized calculation
 Conjugate gradient for all bands (Freysoldt, et al. PRB 79, 241103 (2009))
 perform sub-space diagonalisation
    before iterative eigenvector-optimisation
 modified Broyden-mixing scheme, WC =      100.0
 initial mixing is a Kerker type mixing with AMIX =  0.4000 and BMIX =      1.0000
 Hartree-type preconditioning will be used
 using additional bands            6
 reciprocal scheme for non local part
 use partial core corrections
 no Harris-corrections to forces 
 use gradient corrections 
 use of overlap-Matrix (Vanderbilt PP)
 Methfessel and Paxton  Order N= 1 SIGMA  =   0.20


--------------------------------------------------------------------------------------------------------


  energy-cutoff  :      400.00
  volume of cell :      120.20
      direct lattice vectors                 reciprocal lattice vectors
     2.857459769  0.000000000  0.000000000     0.349961183 -0.202050183  0.000000000
     1.428729885  2.474632750  0.000000000     0.000000000  0.404100366  0.000000000
     0.000000000  0.000000000 16.999318395     0.000000000  0.000000000  0.058825888

  length of vectors
     2.857459769  2.857459769 16.999318395     0.404100366  0.404100366  0.058825888


 
 old parameters found on file WAVECAR:
  energy-cutoff  :      400.00
  volume of cell :      120.20
      direct lattice vectors                 reciprocal lattice vectors
     2.857459769  0.000000000  0.000000000     0.349961183 -0.202050183  0.000000000
     1.428729885  2.474632750  0.000000000     0.000000000  0.404100366  0.000000000
     0.000000000  0.000000000 16.999318395     0.000000000  0.000000000  0.058825888

  length of vectors

 
 k-points in units of 2pi/SCALE and weight: Automatic Mesh                          
   0.00000000  0.00000000  0.00000000       0.003
   0.01749806 -0.01010251  0.00000000       0.005
   0.01749806  0.01010251  0.00000000       0.005
   0.00000000  0.02020502  0.00000000       0.005
   0.03499612 -0.02020502  0.00000000       0.005
   0.03499612  0.02020502  0.00000000       0.005
   0.00000000  0.04041004  0.00000000       0.005
   0.05249418 -0.03030753  0.00000000       0.005
   0.05249418  0.03030753  0.00000000       0.005
   0.00000000  0.06061505  0.00000000       0.005
   0.06999224 -0.04041004  0.00000000       0.005
   0.06999224  0.04041004  0.00000000       0.005
   0.00000000  0.08082007  0.00000000       0.005
   0.08749030 -0.05051255  0.00000000       0.005
   0.08749030  0.05051255  0.00000000       0.005
   0.00000000  0.10102509  0.00000000       0.005
   0.10498835 -0.06061505  0.00000000       0.005
   0.10498835  0.06061505  0.00000000       0.005
   0.00000000  0.12123011  0.00000000       0.005
   0.12248641 -0.07071756  0.00000000       0.005
   0.12248641  0.07071756  0.00000000       0.005
   0.00000000  0.14143513  0.00000000       0.005
   0.13998447 -0.08082007  0.00000000       0.005
   0.13998447  0.08082007  0.00000000       0.005
   0.00000000  0.16164015  0.00000000       0.005
   0.15748253 -0.09092258  0.00000000       0.005
   0.15748253  0.09092258  0.00000000       0.005
   0.00000000  0.18184516  0.00000000       0.005
   0.17498059 -0.10102509  0.00000000       0.003
   0.17498059  0.10102509  0.00000000       0.003
   0.00000000  0.20205018  0.00000000       0.003
   0.03499612 -0.00000000  0.00000000       0.005
   0.01749806  0.03030753  0.00000000       0.005
  -0.01749806  0.03030753  0.00000000       0.005
   0.05249418 -0.01010251  0.00000000       0.005
   0.03499612  0.04041004  0.00000000       0.005
  -0.01749806  0.05051255  0.00000000       0.005
   0.03499612 -0.04041004  0.00000000       0.005
  -0.01749806 -0.05051255  0.00000000       0.005
  -0.05249418 -0.01010251  0.00000000       0.005
   0.06999224 -0.02020502  0.00000000       0.005
   0.05249418  0.05051255  0.00000000       0.005
  -0.01749806  0.07071756  0.00000000       0.005
   0.05249418 -0.05051255  0.00000000       0.005
  -0.01749806 -0.07071756  0.00000000       0.005
  -0.06999224 -0.02020502  0.00000000       0.005
   0.08749030 -0.03030753  0.00000000       0.005
   0.06999224  0.06061505  0.00000000       0.005
  -0.01749806  0.09092258  0.00000000       0.005
   0.06999224 -0.06061505  0.00000000       0.005
  -0.01749806 -0.09092258  0.00000000       0.005
  -0.08749030 -0.03030753  0.00000000       0.005
   0.10498835 -0.04041004  0.00000000       0.005
   0.08749030  0.07071756  0.00000000       0.005
  -0.01749806  0.11112760  0.00000000       0.005
   0.08749030 -0.07071756  0.00000000       0.005
  -0.01749806 -0.11112760  0.00000000       0.005
  -0.10498835 -0.04041004  0.00000000       0.005
   0.12248641 -0.05051255  0.00000000       0.005
   0.10498835  0.08082007  0.00000000       0.005
  -0.01749806  0.13133262  0.00000000       0.005
   0.10498835 -0.08082007  0.00000000       0.005
  -0.01749806 -0.13133262  0.00000000       0.005
  -0.12248641 -0.05051255  0.00000000       0.005
   0.13998447 -0.06061505  0.00000000       0.005
   0.12248641  0.09092258  0.00000000       0.005
  -0.01749806  0.15153764  0.00000000       0.005
   0.12248641 -0.09092258  0.00000000       0.005
  -0.01749806 -0.15153764  0.00000000       0.005
  -0.13998447 -0.06061505  0.00000000       0.005
   0.15748253 -0.07071756  0.00000000       0.005
   0.13998447  0.10102509  0.00000000       0.005
  -0.01749806  0.17174266  0.00000000       0.005
   0.13998447 -0.10102509  0.00000000       0.005
  -0.01749806 -0.17174266  0.00000000       0.005
  -0.15748253 -0.07071756  0.00000000       0.005
   0.17498059 -0.08082007  0.00000000       0.005
   0.15748253  0.11112760  0.00000000       0.005
  -0.01749806  0.19194767  0.00000000       0.005
   0.15748253 -0.11112760  0.00000000       0.005
  -0.01749806  0.21215269  0.00000000       0.005
   0.17498059 -0.28287026  0.00000000       0.005
   0.06999224 -0.00000000  0.00000000       0.005
   0.03499612  0.06061505  0.00000000       0.005
  -0.03499612  0.06061505  0.00000000       0.005
   0.08749030 -0.01010251  0.00000000       0.005
   0.05249418  0.07071756  0.00000000       0.005
  -0.03499612  0.08082007  0.00000000       0.005
   0.05249418 -0.07071756  0.00000000       0.005
  -0.03499612 -0.08082007  0.00000000       0.005
  -0.08749030 -0.01010251  0.00000000       0.005
   0.10498835 -0.02020502  0.00000000       0.005
   0.06999224  0.08082007  0.00000000       0.005
  -0.03499612  0.10102509  0.00000000       0.005
   0.06999224 -0.08082007  0.00000000       0.005
  -0.03499612 -0.10102509  0.00000000       0.005
  -0.10498835 -0.02020502  0.00000000       0.005
   0.12248641 -0.03030753  0.00000000       0.005
   0.08749030  0.09092258  0.00000000       0.005
  -0.03499612  0.12123011  0.00000000       0.005
   0.08749030 -0.09092258  0.00000000       0.005
  -0.03499612 -0.12123011  0.00000000       0.005
  -0.12248641 -0.03030753  0.00000000       0.005
   0.13998447 -0.04041004  0.00000000       0.005
   0.10498835  0.10102509  0.00000000       0.005
  -0.03499612  0.14143513  0.00000000       0.005
   0.10498835 -0.10102509  0.00000000       0.005
  -0.03499612 -0.14143513  0.00000000       0.005
  -0.13998447 -0.04041004  0.00000000       0.005
   0.15748253 -0.05051255  0.00000000       0.005
   0.12248641  0.11112760  0.00000000       0.005
  -0.03499612  0.16164015  0.00000000       0.005
   0.12248641 -0.11112760  0.00000000       0.005
  -0.03499612 -0.16164015  0.00000000       0.005
  -0.15748253 -0.05051255  0.00000000       0.005
   0.17498059 -0.06061505  0.00000000       0.005
   0.13998447  0.12123011  0.00000000       0.005
  -0.03499612  0.18184516  0.00000000       0.005
   0.13998447 -0.12123011  0.00000000       0.005
  -0.03499612  0.22225520  0.00000000       0.005
   0.17498059 -0.26266524  0.00000000       0.005
  -0.15748253  0.13133262  0.00000000       0.005
   0.15748253 -0.27276775  0.00000000       0.005
  -0.03499612  0.20205018  0.00000000       0.005
   0.10498835 -0.00000000  0.00000000       0.005
   0.05249418  0.09092258  0.00000000       0.005
  -0.05249418  0.09092258  0.00000000       0.005
   0.12248641 -0.01010251  0.00000000       0.005
   0.06999224  0.10102509  0.00000000       0.005
  -0.05249418  0.11112760  0.00000000       0.005
   0.06999224 -0.10102509  0.00000000       0.005
  -0.05249418 -0.11112760  0.00000000       0.005
  -0.12248641 -0.01010251  0.00000000       0.005
   0.13998447 -0.02020502  0.00000000       0.005
   0.08749030  0.11112760  0.00000000       0.005
  -0.05249418  0.13133262  0.00000000       0.005
   0.08749030 -0.11112760  0.00000000       0.005
  -0.05249418 -0.13133262  0.00000000       0.005
  -0.13998447 -0.02020502  0.00000000       0.005
   0.15748253 -0.03030753  0.00000000       0.005
   0.10498835  0.12123011  0.00000000       0.005
  -0.05249418  0.15153764  0.00000000       0.005
   0.10498835 -0.12123011  0.00000000       0.005
  -0.05249418 -0.15153764  0.00000000       0.005
  -0.15748253 -0.03030753  0.00000000       0.005
   0.17498059 -0.04041004  0.00000000       0.005
   0.12248641  0.13133262  0.00000000       0.005
  -0.05249418  0.17174266  0.00000000       0.005
   0.12248641 -0.13133262  0.00000000       0.005
  -0.05249418  0.23235771  0.00000000       0.005
   0.17498059 -0.24246022  0.00000000       0.005
  -0.15748253  0.15153764  0.00000000       0.005
   0.13998447 -0.26266524  0.00000000       0.005
  -0.05249418  0.19194767  0.00000000       0.005
   0.13998447 -0.14143513  0.00000000       0.005
  -0.05249418  0.21215269  0.00000000       0.005
   0.15748253 -0.25256273  0.00000000       0.005
   0.13998447  0.00000000  0.00000000       0.005
   0.06999224  0.12123011  0.00000000       0.005
  -0.06999224  0.12123011  0.00000000       0.005
   0.15748253 -0.01010251  0.00000000       0.005
   0.08749030  0.13133262  0.00000000       0.005
  -0.06999224  0.14143513  0.00000000       0.005
   0.08749030 -0.13133262  0.00000000       0.005
  -0.06999224 -0.14143513  0.00000000       0.005
  -0.15748253 -0.01010251  0.00000000       0.005
   0.17498059 -0.02020502  0.00000000       0.005
   0.10498835  0.14143513  0.00000000       0.005
  -0.06999224  0.16164015  0.00000000       0.005
   0.10498835 -0.14143513  0.00000000       0.005
  -0.06999224  0.24246022  0.00000000       0.005
   0.17498059 -0.22225520  0.00000000       0.005
  -0.15748253  0.17174266  0.00000000       0.005
   0.12248641 -0.25256273  0.00000000       0.005
  -0.06999224  0.18184516  0.00000000       0.005
   0.12248641 -0.15153764  0.00000000       0.005
  -0.06999224  0.22225520  0.00000000       0.005
   0.15748253 -0.23235771  0.00000000       0.005
  -0.13998447  0.16164015  0.00000000       0.005
   0.13998447 -0.24246022  0.00000000       0.005
  -0.06999224  0.20205018  0.00000000       0.005
   0.17498059  0.00000000  0.00000000       0.005
   0.08749030  0.15153764  0.00000000       0.005
  -0.08749030  0.15153764  0.00000000       0.005
  -0.15748253  0.19194767  0.00000000       0.005
   0.10498835 -0.24246022  0.00000000       0.005
  -0.08749030  0.17174266  0.00000000       0.005
   0.10498835 -0.16164015  0.00000000       0.005
  -0.08749030  0.23235771  0.00000000       0.005
   0.15748253 -0.21215269  0.00000000       0.005
  -0.13998447  0.18184516  0.00000000       0.005
   0.12248641 -0.23235771  0.00000000       0.005
  -0.08749030  0.19194767  0.00000000       0.005
   0.12248641 -0.17174266  0.00000000       0.005
  -0.08749030  0.21215269  0.00000000       0.005
   0.13998447 -0.22225520  0.00000000       0.005
  -0.13998447  0.20205018  0.00000000       0.005
   0.10498835 -0.22225520  0.00000000       0.005
  -0.10498835  0.18184516  0.00000000       0.005
  -0.12248641  0.19194767  0.00000000       0.005
   0.12248641 -0.21215269  0.00000000       0.005
  -0.10498835  0.20205018  0.00000000       0.005
 
 k-points in reciprocal lattice and weights: Automatic Mesh                          
   0.00000000  0.00000000  0.00000000       0.003
   0.05000000 -0.00000000  0.00000000       0.005
   0.05000000  0.05000000  0.00000000       0.005
   0.00000000  0.05000000  0.00000000       0.005
   0.10000000  0.00000000  0.00000000       0.005
   0.10000000  0.10000000  0.00000000       0.005
   0.00000000  0.10000000  0.00000000       0.005
   0.15000000 -0.00000000  0.00000000       0.005
   0.15000000  0.15000000  0.00000000       0.005
   0.00000000  0.15000000  0.00000000       0.005
   0.20000000  0.00000000  0.00000000       0.005
   0.20000000  0.20000000  0.00000000       0.005
   0.00000000  0.20000000  0.00000000       0.005
   0.25000000 -0.00000000  0.00000000       0.005
   0.25000000  0.25000000  0.00000000       0.005
   0.00000000  0.25000000  0.00000000       0.005
   0.30000000 -0.00000000  0.00000000       0.005
   0.30000000  0.30000000  0.00000000       0.005
   0.00000000  0.30000000  0.00000000       0.005
   0.35000000  0.00000000  0.00000000       0.005
   0.35000000  0.35000000  0.00000000       0.005
   0.00000000  0.35000000  0.00000000       0.005
   0.40000000 -0.00000000  0.00000000       0.005
   0.40000000  0.40000000  0.00000000       0.005
   0.00000000  0.40000000  0.00000000       0.005
   0.45000000 -0.00000000  0.00000000       0.005
   0.45000000  0.45000000  0.00000000       0.005
   0.00000000  0.45000000  0.00000000       0.005
   0.50000000 -0.00000000  0.00000000       0.003
   0.50000000  0.50000000  0.00000000       0.003
   0.00000000  0.50000000  0.00000000       0.003
   0.10000000  0.05000000  0.00000000       0.005
   0.05000000  0.10000000  0.00000000       0.005
  -0.05000000  0.05000000  0.00000000       0.005
   0.15000000  0.05000000  0.00000000       0.005
   0.10000000  0.15000000  0.00000000       0.005
  -0.05000000  0.10000000  0.00000000       0.005
   0.10000000 -0.05000000  0.00000000       0.005
  -0.05000000 -0.15000000  0.00000000       0.005
  -0.15000000 -0.10000000  0.00000000       0.005
   0.20000000  0.05000000  0.00000000       0.005
   0.15000000  0.20000000  0.00000000       0.005
  -0.05000000  0.15000000  0.00000000       0.005
   0.15000000 -0.05000000  0.00000000       0.005
  -0.05000000 -0.20000000  0.00000000       0.005
  -0.20000000 -0.15000000  0.00000000       0.005
   0.25000000  0.05000000  0.00000000       0.005
   0.20000000  0.25000000  0.00000000       0.005
  -0.05000000  0.20000000  0.00000000       0.005
   0.20000000 -0.05000000  0.00000000       0.005
  -0.05000000 -0.25000000  0.00000000       0.005
  -0.25000000 -0.20000000  0.00000000       0.005
   0.30000000  0.05000000  0.00000000       0.005
   0.25000000  0.30000000  0.00000000       0.005
  -0.05000000  0.25000000  0.00000000       0.005
   0.25000000 -0.05000000  0.00000000       0.005
  -0.05000000 -0.30000000  0.00000000       0.005
  -0.30000000 -0.25000000  0.00000000       0.005
   0.35000000  0.05000000  0.00000000       0.005
   0.30000000  0.35000000  0.00000000       0.005
  -0.05000000  0.30000000  0.00000000       0.005
   0.30000000 -0.05000000  0.00000000       0.005
  -0.05000000 -0.35000000  0.00000000       0.005
  -0.35000000 -0.30000000  0.00000000       0.005
   0.40000000  0.05000000  0.00000000       0.005
   0.35000000  0.40000000  0.00000000       0.005
  -0.05000000  0.35000000  0.00000000       0.005
   0.35000000 -0.05000000  0.00000000       0.005
  -0.05000000 -0.40000000  0.00000000       0.005
  -0.40000000 -0.35000000  0.00000000       0.005
   0.45000000  0.05000000  0.00000000       0.005
   0.40000000  0.45000000  0.00000000       0.005
  -0.05000000  0.40000000  0.00000000       0.005
   0.40000000 -0.05000000  0.00000000       0.005
  -0.05000000 -0.45000000  0.00000000       0.005
  -0.45000000 -0.40000000  0.00000000       0.005
   0.50000000  0.05000000  0.00000000       0.005
   0.45000000  0.50000000  0.00000000       0.005
  -0.05000000  0.45000000  0.00000000       0.005
   0.45000000 -0.05000000  0.00000000       0.005
  -0.05000000  0.50000000  0.00000000       0.005
   0.50000000 -0.45000000  0.00000000       0.005
   0.20000000  0.10000000  0.00000000       0.005
   0.10000000  0.20000000  0.00000000       0.005
  -0.10000000  0.10000000  0.00000000       0.005
   0.25000000  0.10000000  0.00000000       0.005
   0.15000000  0.25000000  0.00000000       0.005
  -0.10000000  0.15000000  0.00000000       0.005
   0.15000000 -0.10000000  0.00000000       0.005
  -0.10000000 -0.25000000  0.00000000       0.005
  -0.25000000 -0.15000000  0.00000000       0.005
   0.30000000  0.10000000  0.00000000       0.005
   0.20000000  0.30000000  0.00000000       0.005
  -0.10000000  0.20000000  0.00000000       0.005
   0.20000000 -0.10000000  0.00000000       0.005
  -0.10000000 -0.30000000  0.00000000       0.005
  -0.30000000 -0.20000000  0.00000000       0.005
   0.35000000  0.10000000  0.00000000       0.005
   0.25000000  0.35000000  0.00000000       0.005
  -0.10000000  0.25000000  0.00000000       0.005
   0.25000000 -0.10000000  0.00000000       0.005
  -0.10000000 -0.35000000  0.00000000       0.005
  -0.35000000 -0.25000000  0.00000000       0.005
   0.40000000  0.10000000  0.00000000       0.005
   0.30000000  0.40000000  0.00000000       0.005
  -0.10000000  0.30000000  0.00000000       0.005
   0.30000000 -0.10000000  0.00000000       0.005
  -0.10000000 -0.40000000  0.00000000       0.005
  -0.40000000 -0.30000000  0.00000000       0.005
   0.45000000  0.10000000  0.00000000       0.005
   0.35000000  0.45000000  0.00000000       0.005
  -0.10000000  0.35000000  0.00000000       0.005
   0.35000000 -0.10000000  0.00000000       0.005
  -0.10000000 -0.45000000  0.00000000       0.005
  -0.45000000 -0.35000000  0.00000000       0.005
   0.50000000  0.10000000  0.00000000       0.005
   0.40000000  0.50000000  0.00000000       0.005
  -0.10000000  0.40000000  0.00000000       0.005
   0.40000000 -0.10000000  0.00000000       0.005
  -0.10000000  0.50000000  0.00000000       0.005
   0.50000000 -0.40000000  0.00000000       0.005
  -0.45000000  0.10000000  0.00000000       0.005
   0.45000000 -0.45000000  0.00000000       0.005
  -0.10000000  0.45000000  0.00000000       0.005
   0.30000000  0.15000000  0.00000000       0.005
   0.15000000  0.30000000  0.00000000       0.005
  -0.15000000  0.15000000  0.00000000       0.005
   0.35000000  0.15000000  0.00000000       0.005
   0.20000000  0.35000000  0.00000000       0.005
  -0.15000000  0.20000000  0.00000000       0.005
   0.20000000 -0.15000000  0.00000000       0.005
  -0.15000000 -0.35000000  0.00000000       0.005
  -0.35000000 -0.20000000  0.00000000       0.005
   0.40000000  0.15000000  0.00000000       0.005
   0.25000000  0.40000000  0.00000000       0.005
  -0.15000000  0.25000000  0.00000000       0.005
   0.25000000 -0.15000000  0.00000000       0.005
  -0.15000000 -0.40000000  0.00000000       0.005
  -0.40000000 -0.25000000  0.00000000       0.005
   0.45000000  0.15000000  0.00000000       0.005
   0.30000000  0.45000000  0.00000000       0.005
  -0.15000000  0.30000000  0.00000000       0.005
   0.30000000 -0.15000000  0.00000000       0.005
  -0.15000000 -0.45000000  0.00000000       0.005
  -0.45000000 -0.30000000  0.00000000       0.005
   0.50000000  0.15000000  0.00000000       0.005
   0.35000000  0.50000000  0.00000000       0.005
  -0.15000000  0.35000000  0.00000000       0.005
   0.35000000 -0.15000000  0.00000000       0.005
  -0.15000000  0.50000000  0.00000000       0.005
   0.50000000 -0.35000000  0.00000000       0.005
  -0.45000000  0.15000000  0.00000000       0.005
   0.40000000 -0.45000000  0.00000000       0.005
  -0.15000000  0.40000000  0.00000000       0.005
   0.40000000 -0.15000000  0.00000000       0.005
  -0.15000000  0.45000000  0.00000000       0.005
   0.45000000 -0.40000000  0.00000000       0.005
   0.40000000  0.20000000  0.00000000       0.005
   0.20000000  0.40000000  0.00000000       0.005
  -0.20000000  0.20000000  0.00000000       0.005
   0.45000000  0.20000000  0.00000000       0.005
   0.25000000  0.45000000  0.00000000       0.005
  -0.20000000  0.25000000  0.00000000       0.005
   0.25000000 -0.20000000  0.00000000       0.005
  -0.20000000 -0.45000000  0.00000000       0.005
  -0.45000000 -0.25000000  0.00000000       0.005
   0.50000000  0.20000000  0.00000000       0.005
   0.30000000  0.50000000  0.00000000       0.005
  -0.20000000  0.30000000  0.00000000       0.005
   0.30000000 -0.20000000  0.00000000       0.005
  -0.20000000  0.50000000  0.00000000       0.005
   0.50000000 -0.30000000  0.00000000       0.005
  -0.45000000  0.20000000  0.00000000       0.005
   0.35000000 -0.45000000  0.00000000       0.005
  -0.20000000  0.35000000  0.00000000       0.005
   0.35000000 -0.20000000  0.00000000       0.005
  -0.20000000  0.45000000  0.00000000       0.005
   0.45000000 -0.35000000  0.00000000       0.005
  -0.40000000  0.20000000  0.00000000       0.005
   0.40000000 -0.40000000  0.00000000       0.005
  -0.20000000  0.40000000  0.00000000       0.005
   0.50000000  0.25000000  0.00000000       0.005
   0.25000000  0.50000000  0.00000000       0.005
  -0.25000000  0.25000000  0.00000000       0.005
  -0.45000000  0.25000000  0.00000000       0.005
   0.30000000 -0.45000000  0.00000000       0.005
  -0.25000000  0.30000000  0.00000000       0.005
   0.30000000 -0.25000000  0.00000000       0.005
  -0.25000000  0.45000000  0.00000000       0.005
   0.45000000 -0.30000000  0.00000000       0.005
  -0.40000000  0.25000000  0.00000000       0.005
   0.35000000 -0.40000000  0.00000000       0.005
  -0.25000000  0.35000000  0.00000000       0.005
   0.35000000 -0.25000000  0.00000000       0.005
  -0.25000000  0.40000000  0.00000000       0.005
   0.40000000 -0.35000000  0.00000000       0.005
  -0.40000000  0.30000000  0.00000000       0.005
   0.30000000 -0.40000000  0.00000000       0.005
  -0.30000000  0.30000000  0.00000000       0.005
  -0.35000000  0.30000000  0.00000000       0.005
   0.35000000 -0.35000000  0.00000000       0.005
  -0.30000000  0.35000000  0.00000000       0.005
 
 position of ions in fractional coordinates (direct lattice) 
   0.00000000  0.00000000  0.00000000
   0.33333333  0.33333333  0.13724704
   0.66666667  0.66666667  0.27449408
   0.00000000  0.00000000  0.41174112
 
 position of ions in cartesian coordinates  (Angst):
   0.00000000  0.00000000  0.00000000
   1.42872988  0.82487758  2.33310613
   2.85745977  1.64975517  4.66621226
   0.00000000  0.00000000  6.99931839
 


--------------------------------------------------------------------------------------------------------


 k-point   1 :   0.0000 0.0000 0.0000  plane waves:    2203
 k-point   2 :   0.0500-0.0000 0.0000  plane waves:    2186
 k-point   3 :   0.0500 0.0500 0.0000  plane waves:    2186
 k-point   4 :   0.0000 0.0500 0.0000  plane waves:    2186
 k-point   5 :   0.1000 0.0000 0.0000  plane waves:    2202
 k-point   6 :   0.1000 0.1000 0.0000  plane waves:    2202
 k-point   7 :   0.0000 0.1000 0.0000  plane waves:    2202
 k-point   8 :   0.1500-0.0000 0.0000  plane waves:    2196
 k-point   9 :   0.1500 0.1500 0.0000  plane waves:    2196
 k-point  10 :   0.0000 0.1500 0.0000  plane waves:    2196
 k-point  11 :   0.2000 0.0000 0.0000  plane waves:    2196
 k-point  12 :   0.2000 0.2000 0.0000  plane waves:    2196
 k-point  13 :   0.0000 0.2000 0.0000  plane waves:    2196
 k-point  14 :   0.2500-0.0000 0.0000  plane waves:    2200
 k-point  15 :   0.2500 0.2500 0.0000  plane waves:    2200
 k-point  16 :   0.0000 0.2500 0.0000  plane waves:    2200
 k-point  17 :   0.3000-0.0000 0.0000  plane waves:    2196
 k-point  18 :   0.3000 0.3000 0.0000  plane waves:    2196
 k-point  19 :   0.0000 0.3000 0.0000  plane waves:    2196
 k-point  20 :   0.3500 0.0000 0.0000  plane waves:    2180
 k-point  21 :   0.3500 0.3500 0.0000  plane waves:    2180
 k-point  22 :   0.0000 0.3500 0.0000  plane waves:    2180
 k-point  23 :   0.4000-0.0000 0.0000  plane waves:    2178
 k-point  24 :   0.4000 0.4000 0.0000  plane waves:    2178
 k-point  25 :   0.0000 0.4000 0.0000  plane waves:    2178
 k-point  26 :   0.4500-0.0000 0.0000  plane waves:    2184
 k-point  27 :   0.4500 0.4500 0.0000  plane waves:    2184
 k-point  28 :   0.0000 0.4500 0.0000  plane waves:    2184
 k-point  29 :   0.5000-0.0000 0.0000  plane waves:    2188
 k-point  30 :   0.5000 0.5000 0.0000  plane waves:    2188
 k-point  31 :   0.0000 0.5000 0.0000  plane waves:    2188
 k-point  32 :   0.1000 0.0500 0.0000  plane waves:    2199
 k-point  33 :   0.0500 0.1000 0.0000  plane waves:    2199
 k-point  34 :  -0.0500 0.0500 0.0000  plane waves:    2199
 k-point  35 :   0.1500 0.0500 0.0000  plane waves:    2199
 k-point  36 :   0.1000 0.1500 0.0000  plane waves:    2199
 k-point  37 :  -0.0500 0.1000 0.0000  plane waves:    2199
 k-point  38 :   0.1000-0.0500 0.0000  plane waves:    2199
 k-point  39 :  -0.0500-0.1500 0.0000  plane waves:    2199
 k-point  40 :  -0.1500-0.1000 0.0000  plane waves:    2199
 k-point  41 :   0.2000 0.0500 0.0000  plane waves:    2192
 k-point  42 :   0.1500 0.2000 0.0000  plane waves:    2192
 k-point  43 :  -0.0500 0.1500 0.0000  plane waves:    2192
 k-point  44 :   0.1500-0.0500 0.0000  plane waves:    2192
 k-point  45 :  -0.0500-0.2000 0.0000  plane waves:    2192
 k-point  46 :  -0.2000-0.1500 0.0000  plane waves:    2192
 k-point  47 :   0.2500 0.0500 0.0000  plane waves:    2196
 k-point  48 :   0.2000 0.2500 0.0000  plane waves:    2196
 k-point  49 :  -0.0500 0.2000 0.0000  plane waves:    2196
 k-point  50 :   0.2000-0.0500 0.0000  plane waves:    2196
 k-point  51 :  -0.0500-0.2500 0.0000  plane waves:    2196
 k-point  52 :  -0.2500-0.2000 0.0000  plane waves:    2196
 k-point  53 :   0.3000 0.0500 0.0000  plane waves:    2190
 k-point  54 :   0.2500 0.3000 0.0000  plane waves:    2190
 k-point  55 :  -0.0500 0.2500 0.0000  plane waves:    2190
 k-point  56 :   0.2500-0.0500 0.0000  plane waves:    2190
 k-point  57 :  -0.0500-0.3000 0.0000  plane waves:    2190
 k-point  58 :  -0.3000-0.2500 0.0000  plane waves:    2190
 k-point  59 :   0.3500 0.0500 0.0000  plane waves:    2180
 k-point  60 :   0.3000 0.3500 0.0000  plane waves:    2180
 k-point  61 :  -0.0500 0.3000 0.0000  plane waves:    2180
 k-point  62 :   0.3000-0.0500 0.0000  plane waves:    2180
 k-point  63 :  -0.0500-0.3500 0.0000  plane waves:    2180
 k-point  64 :  -0.3500-0.3000 0.0000  plane waves:    2180
 k-point  65 :   0.4000 0.0500 0.0000  plane waves:    2189
 k-point  66 :   0.3500 0.4000 0.0000  plane waves:    2189
 k-point  67 :  -0.0500 0.3500 0.0000  plane waves:    2189
 k-point  68 :   0.3500-0.0500 0.0000  plane waves:    2189
 k-point  69 :  -0.0500-0.4000 0.0000  plane waves:    2189
 k-point  70 :  -0.4000-0.3500 0.0000  plane waves:    2189
 k-point  71 :   0.4500 0.0500 0.0000  plane waves:    2185
 k-point  72 :   0.4000 0.4500 0.0000  plane waves:    2185
 k-point  73 :  -0.0500 0.4000 0.0000  plane waves:    2185
 k-point  74 :   0.4000-0.0500 0.0000  plane waves:    2185
 k-point  75 :  -0.0500-0.4500 0.0000  plane waves:    2185
 k-point  76 :  -0.4500-0.4000 0.0000  plane waves:    2185
 k-point  77 :   0.5000 0.0500 0.0000  plane waves:    2184
 k-point  78 :   0.4500 0.5000 0.0000  plane waves:    2184
 k-point  79 :  -0.0500 0.4500 0.0000  plane waves:    2184
 k-point  80 :   0.4500-0.0500 0.0000  plane waves:    2184
 k-point  81 :  -0.0500 0.5000 0.0000  plane waves:    2184
 k-point  82 :   0.5000-0.4500 0.0000  plane waves:    2184
 k-point  83 :   0.2000 0.1000 0.0000  plane waves:    2203
 k-point  84 :   0.1000 0.2000 0.0000  plane waves:    2203
 k-point  85 :  -0.1000 0.1000 0.0000  plane waves:    2203
 k-point  86 :   0.2500 0.1000 0.0000  plane waves:    2197
 k-point  87 :   0.1500 0.2500 0.0000  plane waves:    2197
 k-point  88 :  -0.1000 0.1500 0.0000  plane waves:    2197
 k-point  89 :   0.1500-0.1000 0.0000  plane waves:    2197
 k-point  90 :  -0.1000-0.2500 0.0000  plane waves:    2197
 k-point  91 :  -0.2500-0.1500 0.0000  plane waves:    2197
 k-point  92 :   0.3000 0.1000 0.0000  plane waves:    2194
 k-point  93 :   0.2000 0.3000 0.0000  plane waves:    2194
 k-point  94 :  -0.1000 0.2000 0.0000  plane waves:    2194
 k-point  95 :   0.2000-0.1000 0.0000  plane waves:    2194
 k-point  96 :  -0.1000-0.3000 0.0000  plane waves:    2194
 k-point  97 :  -0.3000-0.2000 0.0000  plane waves:    2194
 k-point  98 :   0.3500 0.1000 0.0000  plane waves:    2186
 k-point  99 :   0.2500 0.3500 0.0000  plane waves:    2186
 k-point 100 :  -0.1000 0.2500 0.0000  plane waves:    2186
 k-point 101 :   0.2500-0.1000 0.0000  plane waves:    2186
 k-point 102 :  -0.1000-0.3500 0.0000  plane waves:    2186
 k-point 103 :  -0.3500-0.2500 0.0000  plane waves:    2186
 k-point 104 :   0.4000 0.1000 0.0000  plane waves:    2184
 k-point 105 :   0.3000 0.4000 0.0000  plane waves:    2184
 k-point 106 :  -0.1000 0.3000 0.0000  plane waves:    2184
 k-point 107 :   0.3000-0.1000 0.0000  plane waves:    2184
 k-point 108 :  -0.1000-0.4000 0.0000  plane waves:    2184
 k-point 109 :  -0.4000-0.3000 0.0000  plane waves:    2184
 k-point 110 :   0.4500 0.1000 0.0000  plane waves:    2183
 k-point 111 :   0.3500 0.4500 0.0000  plane waves:    2183
 k-point 112 :  -0.1000 0.3500 0.0000  plane waves:    2183
 k-point 113 :   0.3500-0.1000 0.0000  plane waves:    2183
 k-point 114 :  -0.1000-0.4500 0.0000  plane waves:    2183
 k-point 115 :  -0.4500-0.3500 0.0000  plane waves:    2183
 k-point 116 :   0.5000 0.1000 0.0000  plane waves:    2178
 k-point 117 :   0.4000 0.5000 0.0000  plane waves:    2178
 k-point 118 :  -0.1000 0.4000 0.0000  plane waves:    2178
 k-point 119 :   0.4000-0.1000 0.0000  plane waves:    2178
 k-point 120 :  -0.1000 0.5000 0.0000  plane waves:    2178
 k-point 121 :   0.5000-0.4000 0.0000  plane waves:    2178
 k-point 122 :  -0.4500 0.1000 0.0000  plane waves:    2172
 k-point 123 :   0.4500-0.4500 0.0000  plane waves:    2172
 k-point 124 :  -0.1000 0.4500 0.0000  plane waves:    2172
 k-point 125 :   0.3000 0.1500 0.0000  plane waves:    2199
 k-point 126 :   0.1500 0.3000 0.0000  plane waves:    2199
 k-point 127 :  -0.1500 0.1500 0.0000  plane waves:    2199
 k-point 128 :   0.3500 0.1500 0.0000  plane waves:    2180
 k-point 129 :   0.2000 0.3500 0.0000  plane waves:    2180
 k-point 130 :  -0.1500 0.2000 0.0000  plane waves:    2180
 k-point 131 :   0.2000-0.1500 0.0000  plane waves:    2180
 k-point 132 :  -0.1500-0.3500 0.0000  plane waves:    2180
 k-point 133 :  -0.3500-0.2000 0.0000  plane waves:    2180
 k-point 134 :   0.4000 0.1500 0.0000  plane waves:    2190
 k-point 135 :   0.2500 0.4000 0.0000  plane waves:    2190
 k-point 136 :  -0.1500 0.2500 0.0000  plane waves:    2190
 k-point 137 :   0.2500-0.1500 0.0000  plane waves:    2190
 k-point 138 :  -0.1500-0.4000 0.0000  plane waves:    2190
 k-point 139 :  -0.4000-0.2500 0.0000  plane waves:    2190
 k-point 140 :   0.4500 0.1500 0.0000  plane waves:    2190
 k-point 141 :   0.3000 0.4500 0.0000  plane waves:    2190
 k-point 142 :  -0.1500 0.3000 0.0000  plane waves:    2190
 k-point 143 :   0.3000-0.1500 0.0000  plane waves:    2190
 k-point 144 :  -0.1500-0.4500 0.0000  plane waves:    2190
 k-point 145 :  -0.4500-0.3000 0.0000  plane waves:    2190
 k-point 146 :   0.5000 0.1500 0.0000  plane waves:    2180
 k-point 147 :   0.3500 0.5000 0.0000  plane waves:    2180
 k-point 148 :  -0.1500 0.3500 0.0000  plane waves:    2180
 k-point 149 :   0.3500-0.1500 0.0000  plane waves:    2180
 k-point 150 :  -0.1500 0.5000 0.0000  plane waves:    2180
 k-point 151 :   0.5000-0.3500 0.0000  plane waves:    2180
 k-point 152 :  -0.4500 0.1500 0.0000  plane waves:    2170
 k-point 153 :   0.4000-0.4500 0.0000  plane waves:    2170
 k-point 154 :  -0.1500 0.4000 0.0000  plane waves:    2170
 k-point 155 :   0.4000-0.1500 0.0000  plane waves:    2170
 k-point 156 :  -0.1500 0.4500 0.0000  plane waves:    2170
 k-point 157 :   0.4500-0.4000 0.0000  plane waves:    2170
 k-point 158 :   0.4000 0.2000 0.0000  plane waves:    2197
 k-point 159 :   0.2000 0.4000 0.0000  plane waves:    2197
 k-point 160 :  -0.2000 0.2000 0.0000  plane waves:    2197
 k-point 161 :   0.4500 0.2000 0.0000  plane waves:    2188
 k-point 162 :   0.2500 0.4500 0.0000  plane waves:    2188
 k-point 163 :  -0.2000 0.2500 0.0000  plane waves:    2188
 k-point 164 :   0.2500-0.2000 0.0000  plane waves:    2188
 k-point 165 :  -0.2000-0.4500 0.0000  plane waves:    2188
 k-point 166 :  -0.4500-0.2500 0.0000  plane waves:    2188
 k-point 167 :   0.5000 0.2000 0.0000  plane waves:    2179
 k-point 168 :   0.3000 0.5000 0.0000  plane waves:    2179
 k-point 169 :  -0.2000 0.3000 0.0000  plane waves:    2179
 k-point 170 :   0.3000-0.2000 0.0000  plane waves:    2179
 k-point 171 :  -0.2000 0.5000 0.0000  plane waves:    2179
 k-point 172 :   0.5000-0.3000 0.0000  plane waves:    2179
 k-point 173 :  -0.4500 0.2000 0.0000  plane waves:    2169
 k-point 174 :   0.3500-0.4500 0.0000  plane waves:    2169
 k-point 175 :  -0.2000 0.3500 0.0000  plane waves:    2169
 k-point 176 :   0.3500-0.2000 0.0000  plane waves:    2169
 k-point 177 :  -0.2000 0.4500 0.0000  plane waves:    2169
 k-point 178 :   0.4500-0.3500 0.0000  plane waves:    2169
 k-point 179 :  -0.4000 0.2000 0.0000  plane waves:    2164
 k-point 180 :   0.4000-0.4000 0.0000  plane waves:    2164
 k-point 181 :  -0.2000 0.4000 0.0000  plane waves:    2164
 k-point 182 :   0.5000 0.2500 0.0000  plane waves:    2187
 k-point 183 :   0.2500 0.5000 0.0000  plane waves:    2187
 k-point 184 :  -0.2500 0.2500 0.0000  plane waves:    2187
 k-point 185 :  -0.4500 0.2500 0.0000  plane waves:    2158
 k-point 186 :   0.3000-0.4500 0.0000  plane waves:    2158
 k-point 187 :  -0.2500 0.3000 0.0000  plane waves:    2158
 k-point 188 :   0.3000-0.2500 0.0000  plane waves:    2158
 k-point 189 :  -0.2500 0.4500 0.0000  plane waves:    2158
 k-point 190 :   0.4500-0.3000 0.0000  plane waves:    2158
 k-point 191 :  -0.4000 0.2500 0.0000  plane waves:    2159
 k-point 192 :   0.3500-0.4000 0.0000  plane waves:    2159
 k-point 193 :  -0.2500 0.3500 0.0000  plane waves:    2159
 k-point 194 :   0.3500-0.2500 0.0000  plane waves:    2159
 k-point 195 :  -0.2500 0.4000 0.0000  plane waves:    2159
 k-point 196 :   0.4000-0.3500 0.0000  plane waves:    2159
 k-point 197 :  -0.4000 0.3000 0.0000  plane waves:    2147
 k-point 198 :   0.3000-0.4000 0.0000  plane waves:    2147
 k-point 199 :  -0.3000 0.3000 0.0000  plane waves:    2147
 k-point 200 :  -0.3500 0.3000 0.0000  plane waves:    2134
 k-point 201 :   0.3500-0.3500 0.0000  plane waves:    2134
 k-point 202 :  -0.3000 0.3500 0.0000  plane waves:    2134

 maximum and minimum number of plane-waves per node :       583      517

 maximum number of plane-waves:      2203
 maximum index in each direction: 
   IXMAX=    5   IYMAX=    5   IZMAX=   27
   IXMIN=   -5   IYMIN=   -5   IZMIN=  -27


 parallel 3D FFT for wavefunctions:
    minimum data exchange during FFTs selected (reduces bandwidth)
 parallel 3D FFT for charge:
    minimum data exchange during FFTs selected (reduces bandwidth)


 FFT grid for exact exchange (Hartree Fock) 
  NGX = 14; NGY = 14; NGZ = 84

 
 Radii for the augmentation spheres in the non-local exchange
 for species   1 augmentation radius   1.301 (default was   1.041)
       energy cutoff for augmentation   1600.0

 real space projection operators:
  total allocation   :        356.20 KBytes
  max/ min on nodes  :        105.75         72.14

 Maximum index for augmentation-charges in exchange          392
  SETUP_FOCK is finished

 total amount of memory used by VASP MPI-rank0    79626. kBytes
=======================================================================

   base      :      30000. kBytes
   nonl-proj :       7691. kBytes
   fftplans  :       3956. kBytes
   grid      :       2848. kBytes
   one-center:          6. kBytes
   HF        :          4. kBytes
   nonlr-proj:        216. kBytes
   wavefun   :      34905. kBytes
 
     INWAV:  cpu time      1.0120: real time      1.0177
 Broyden mixing: mesh for mixing (old mesh)
   NGX =  9   NGY =  9   NGZ = 55
  (NGX  = 40   NGY  = 40   NGZ  =224)
  gives a total of   4455 points

 charge density for first step will be calculated from the start-wavefunctions


--------------------------------------------------------------------------------------------------------


 Maximum index for augmentation-charges         7130 (set IRDMAX)


--------------------------------------------------------------------------------------------------------


 initial charge from wavefunction
 First call to EWALD:  gamma=   0.359
 Maximum number of real-space cells 5x 5x 1
 Maximum number of reciprocal cells 2x 2x 8

    FEWALD:  cpu time      0.0020: real time      0.0020


--------------------------------------- Iteration      1(   1)  ---------------------------------------


vdW kernel read from vdw_kernel.bindat
  0.0000  0.2424  0.5071  0.7962  1.1119  1.4567  1.8333  2.2446  2.6937  3.1842
  3.7199  4.3049  4.9438  5.6415  6.4036  7.2358  8.1446  9.1372 10.2212 11.4050
 12.6979 14.1099 15.6519 17.3360 19.1751 21.1837 23.3773 25.7729 28.3892 31.2465
 34.3669 37.7748 41.4965 45.5611 50.0000
 
    POTLOK:  cpu time      2.4599: real time      2.4756
    SETDIJ:  cpu time      1.2409: real time      1.2463
    TRIAL :  cpu time   1374.5976: real time   1380.3369
    CORREC:  cpu time      0.0069: real time      0.0069
    CHARGE:  cpu time      0.2433: real time      0.2444
    --------------------------------------------
      LOOP:  cpu time   1378.5529: real time   1384.3488

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1014722E+02  (-0.1236083E+00)
 number of electron      12.0000000 magnetization      -0.0000007
 augmentation part       -0.1697361 magnetization       0.0000005

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.98001800
  -exchange      EXHF   =        26.44443305
  -V(xc)+E(xc)   XCENC  =       -66.97427785
  PAW double counting   =       338.74544064     -257.99714395
  entropy T*S    EENTRO =         0.00216647
  eigenvalues    EBANDS =       -33.89906096
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.14722446 eV

  energy without entropy =      -10.14939092  energy(sigma->0) =      -10.14794661
  exchange ACFDT corr.  =         0.00048604  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(   2)  ---------------------------------------


    POTLOK:  cpu time      0.3880: real time      0.3894
    SETDIJ:  cpu time      0.7905: real time      0.7925
    TRIAL :  cpu time   1341.5864: real time   1347.1495
    CORREC:  cpu time      0.0071: real time      0.0071
    CHARGE:  cpu time      0.2433: real time      0.2443
    --------------------------------------------
      LOOP:  cpu time   1343.0156: real time   1348.5831

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1148929E+00  (-0.1564684E+00)
 number of electron      12.0000000 magnetization      -0.0000010
 augmentation part       -0.1473430 magnetization       0.0000003

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.60983496
  -exchange      EXHF   =        26.44607018
  -V(xc)+E(xc)   XCENC  =       -66.95458590
  PAW double counting   =       496.97234662     -416.20870311
  entropy T*S    EENTRO =         0.00212670
  eigenvalues    EBANDS =       -34.42081941
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.26211736 eV

  energy without entropy =      -10.26424406  energy(sigma->0) =      -10.26282626
  exchange ACFDT corr.  =         0.00028876  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(   3)  ---------------------------------------


    POTLOK:  cpu time      0.3877: real time      0.3890
    SETDIJ:  cpu time      0.7909: real time      0.7929
    TRIAL :  cpu time   1343.3726: real time   1348.9659
    CORREC:  cpu time      0.0069: real time      0.0069
    CHARGE:  cpu time      0.2436: real time      0.2447
    --------------------------------------------
      LOOP:  cpu time   1344.8025: real time   1350.4002

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1404979E+00  (-0.1409093E+00)
 number of electron      12.0000000 magnetization      -0.0000014
 augmentation part       -0.1241321 magnetization       0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.26740835
  -exchange      EXHF   =        26.45155998
  -V(xc)+E(xc)   XCENC  =       -66.92782461
  PAW double counting   =       973.17353565     -892.39069905
  entropy T*S    EENTRO =         0.00200256
  eigenvalues    EBANDS =       -34.95514830
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.40261522 eV

  energy without entropy =      -10.40461778  energy(sigma->0) =      -10.40328274
  exchange ACFDT corr.  =         0.00027276  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(   4)  ---------------------------------------


    POTLOK:  cpu time      0.3859: real time      0.3873
    SETDIJ:  cpu time      0.7893: real time      0.7914
    TRIAL :  cpu time   1340.2986: real time   1345.7162
    CORREC:  cpu time      0.0066: real time      0.0066
    CHARGE:  cpu time      0.2431: real time      0.2441
    --------------------------------------------
      LOOP:  cpu time   1341.7239: real time   1347.1459

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1260029E+00  (-0.1170678E+00)
 number of electron      12.0000000 magnetization      -0.0000017
 augmentation part       -0.1029215 magnetization       0.0000002

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.17497073
  -exchange      EXHF   =        26.46168442
  -V(xc)+E(xc)   XCENC  =       -66.90313624
  PAW double counting   =      2095.44450780    -2014.64638058
  entropy T*S    EENTRO =         0.00179336
  eigenvalues    EBANDS =       -35.22356813
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.52861816 eV

  energy without entropy =      -10.53041152  energy(sigma->0) =      -10.52921594
  exchange ACFDT corr.  =         0.00020601  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(   5)  ---------------------------------------


    POTLOK:  cpu time      0.3858: real time      0.3872
    SETDIJ:  cpu time      0.7894: real time      0.7914
    TRIAL :  cpu time   1341.8751: real time   1347.3553
    CORREC:  cpu time      0.0073: real time      0.0073
    CHARGE:  cpu time      0.2429: real time      0.2439
    --------------------------------------------
      LOOP:  cpu time   1343.3008: real time   1348.7854

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1059530E+00  (-0.9730310E-01)
 number of electron      12.0000000 magnetization      -0.0000020
 augmentation part       -0.0844877 magnetization       0.0000003

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.31195920
  -exchange      EXHF   =        26.47383711
  -V(xc)+E(xc)   XCENC  =       -66.88606571
  PAW double counting   =      4256.40664132    -4175.60088761
  entropy T*S    EENTRO =         0.00153282
  eigenvalues    EBANDS =       -35.22917314
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.63457111 eV

  energy without entropy =      -10.63610393  energy(sigma->0) =      -10.63508205
  exchange ACFDT corr.  =         0.00017616  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(   6)  ---------------------------------------


    POTLOK:  cpu time      0.3862: real time      0.3875
    SETDIJ:  cpu time      0.7889: real time      0.7909
    TRIAL :  cpu time   1354.5786: real time   1360.0578
    CORREC:  cpu time      0.0067: real time      0.0067
    CHARGE:  cpu time      0.2430: real time      0.2440
    --------------------------------------------
      LOOP:  cpu time   1356.0037: real time   1361.4874

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.8858686E-01  (-0.7934154E-01)
 number of electron      12.0000000 magnetization      -0.0000023
 augmentation part       -0.0685015 magnetization       0.0000007

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.52619515
  -exchange      EXHF   =        26.48382322
  -V(xc)+E(xc)   XCENC  =       -66.87823238
  PAW double counting   =      7791.38147798    -7710.57603778
  entropy T*S    EENTRO =         0.00126249
  eigenvalues    EBANDS =       -35.12076943
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.72315797 eV

  energy without entropy =      -10.72442046  energy(sigma->0) =      -10.72357880
  exchange ACFDT corr.  =         0.00009421  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(   7)  ---------------------------------------


    POTLOK:  cpu time      0.3858: real time      0.3872
    SETDIJ:  cpu time      0.7885: real time      0.7906
    TRIAL :  cpu time   1332.8532: real time   1338.2936
    CORREC:  cpu time      0.0065: real time      0.0066
    CHARGE:  cpu time      0.2424: real time      0.2434
    --------------------------------------------
      LOOP:  cpu time   1334.2769: real time   1339.7218

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.7170983E-01  (-0.6128472E-01)
 number of electron      12.0000000 magnetization      -0.0000025
 augmentation part       -0.0543309 magnetization       0.0000011

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.68490606
  -exchange      EXHF   =        26.48892710
  -V(xc)+E(xc)   XCENC  =       -66.87785753
  PAW double counting   =     12934.96569719   -12854.16611383
  entropy T*S    EENTRO =         0.00101046
  eigenvalues    EBANDS =       -35.03311992
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.79486780 eV

  energy without entropy =      -10.79587826  energy(sigma->0) =      -10.79520462
  exchange ACFDT corr.  =        -0.00001792  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(   8)  ---------------------------------------


    POTLOK:  cpu time      0.3864: real time      0.3878
    SETDIJ:  cpu time      0.7904: real time      0.7923
    TRIAL :  cpu time   1332.1940: real time   1337.4899
    CORREC:  cpu time      0.0071: real time      0.0071
    CHARGE:  cpu time      0.2426: real time      0.2437
    --------------------------------------------
      LOOP:  cpu time   1333.6209: real time   1338.9211

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.5461351E-01  (-0.4437750E-01)
 number of electron      12.0000000 magnetization      -0.0000027
 augmentation part       -0.0415755 magnetization       0.0000014

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.74394143
  -exchange      EXHF   =        26.48940941
  -V(xc)+E(xc)   XCENC  =       -66.88129476
  PAW double counting   =     19836.55084665   -19755.75937226
  entropy T*S    EENTRO =         0.00078746
  eigenvalues    EBANDS =       -35.01738213
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.84948131 eV

  energy without entropy =      -10.85026877  energy(sigma->0) =      -10.84974379
  exchange ACFDT corr.  =        -0.00019089  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(   9)  ---------------------------------------


    POTLOK:  cpu time      0.3868: real time      0.3882
    SETDIJ:  cpu time      0.7894: real time      0.7915
    TRIAL :  cpu time   1335.5084: real time   1340.9778
    CORREC:  cpu time      0.0066: real time      0.0066
    CHARGE:  cpu time      0.2442: real time      0.2452
    --------------------------------------------
      LOOP:  cpu time   1336.9358: real time   1342.4096

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.3895319E-01  (-0.3002659E-01)
 number of electron      12.0000000 magnetization      -0.0000029
 augmentation part       -0.0303165 magnetization       0.0000015

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.73874910
  -exchange      EXHF   =        26.48774078
  -V(xc)+E(xc)   XCENC  =       -66.88498039
  PAW double counting   =     28511.21104313   -28430.42704465
  entropy T*S    EENTRO =         0.00059507
  eigenvalues    EBANDS =       -35.04847447
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.88843450 eV

  energy without entropy =      -10.88902957  energy(sigma->0) =      -10.88863286
  exchange ACFDT corr.  =        -0.00027594  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  10)  ---------------------------------------


    POTLOK:  cpu time      0.3848: real time      0.3862
    SETDIJ:  cpu time      0.7902: real time      0.7923
    TRIAL :  cpu time   1338.5774: real time   1344.0957
    CORREC:  cpu time      0.0066: real time      0.0066
    CHARGE:  cpu time      0.2436: real time      0.2447
    --------------------------------------------
      LOOP:  cpu time   1340.0029: real time   1345.5257

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.2591637E-01  (-0.1862900E-01)
 number of electron      12.0000000 magnetization      -0.0000031
 augmentation part       -0.0209630 magnetization       0.0000013

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.73308528
  -exchange      EXHF   =        26.48650043
  -V(xc)+E(xc)   XCENC  =       -66.88694013
  PAW double counting   =     38612.71111639   -38531.93273346
  entropy T*S    EENTRO =         0.00043290
  eigenvalues    EBANDS =       -35.07104666
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.91435087 eV

  energy without entropy =      -10.91478377  energy(sigma->0) =      -10.91449517
  exchange ACFDT corr.  =        -0.00035064  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  11)  ---------------------------------------


    POTLOK:  cpu time      0.3867: real time      0.3881
    SETDIJ:  cpu time      0.7906: real time      0.7927
    TRIAL :  cpu time   1336.4039: real time   1341.9175
    CORREC:  cpu time      0.0067: real time      0.0067
    CHARGE:  cpu time      0.2427: real time      0.2437
    --------------------------------------------
      LOOP:  cpu time   1337.8313: real time   1343.3495

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1574688E-01  (-0.1041920E-01)
 number of electron      12.0000000 magnetization      -0.0000032
 augmentation part       -0.0137751 magnetization       0.0000009

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.75805550
  -exchange      EXHF   =        26.48657203
  -V(xc)+E(xc)   XCENC  =       -66.88727510
  PAW double counting   =     49244.91134004   -49164.13673514
  entropy T*S    EENTRO =         0.00030031
  eigenvalues    EBANDS =       -35.05761973
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.93009775 eV

  energy without entropy =      -10.93039806  energy(sigma->0) =      -10.93019785
  exchange ACFDT corr.  =        -0.00041648  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  12)  ---------------------------------------


    POTLOK:  cpu time      0.3861: real time      0.3874
    SETDIJ:  cpu time      0.7906: real time      0.7926
    TRIAL :  cpu time   1338.6269: real time   1344.0424
    CORREC:  cpu time      0.0067: real time      0.0067
    CHARGE:  cpu time      0.2438: real time      0.2449
    --------------------------------------------
      LOOP:  cpu time   1340.0544: real time   1345.4743

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.8584334E-02  (-0.5219513E-02)
 number of electron      12.0000000 magnetization      -0.0000034
 augmentation part       -0.0086631 magnetization       0.0000004

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.79650948
  -exchange      EXHF   =        26.48729300
  -V(xc)+E(xc)   XCENC  =       -66.88712487
  PAW double counting   =     59247.95793369   -59167.18619917
  entropy T*S    EENTRO =         0.00019500
  eigenvalues    EBANDS =       -35.02561832
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.93868208 eV

  energy without entropy =      -10.93887709  energy(sigma->0) =      -10.93874708
  exchange ACFDT corr.  =        -0.00047289  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  13)  ---------------------------------------


    POTLOK:  cpu time      0.3866: real time      0.3880
    SETDIJ:  cpu time      0.7909: real time      0.7930
    TRIAL :  cpu time   1290.0588: real time   1295.3326
    CORREC:  cpu time      0.0068: real time      0.0068
    CHARGE:  cpu time      0.2442: real time      0.2452
    --------------------------------------------
      LOOP:  cpu time   1291.4877: real time   1296.7659

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.4173854E-02  (-0.2331974E-02)
 number of electron      12.0000000 magnetization      -0.0000035
 augmentation part       -0.0052816 magnetization       0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.82290740
  -exchange      EXHF   =        26.48787735
  -V(xc)+E(xc)   XCENC  =       -66.88734648
  PAW double counting   =     67682.91893772   -67602.14962554
  entropy T*S    EENTRO =         0.00011270
  eigenvalues    EBANDS =       -35.00122933
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94285594 eV

  energy without entropy =      -10.94296863  energy(sigma->0) =      -10.94289350
  exchange ACFDT corr.  =        -0.00051934  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  14)  ---------------------------------------


    POTLOK:  cpu time      0.3864: real time      0.3878
    SETDIJ:  cpu time      0.7911: real time      0.7931
    TRIAL :  cpu time   1295.3041: real time   1300.7624
    CORREC:  cpu time      0.0073: real time      0.0073
    CHARGE:  cpu time      0.2435: real time      0.2445
    --------------------------------------------
      LOOP:  cpu time   1296.7326: real time   1302.1954

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1793459E-02  (-0.9187979E-03)
 number of electron      12.0000000 magnetization      -0.0000036
 augmentation part       -0.0032020 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.83187650
  -exchange      EXHF   =        26.48813414
  -V(xc)+E(xc)   XCENC  =       -66.88802025
  PAW double counting   =     74087.14586369   -74006.37882320
  entropy T*S    EENTRO =         0.00004855
  eigenvalues    EBANDS =       -34.99128273
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94464940 eV

  energy without entropy =      -10.94469795  energy(sigma->0) =      -10.94466558
  exchange ACFDT corr.  =        -0.00055707  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  15)  ---------------------------------------


    POTLOK:  cpu time      0.3862: real time      0.3876
    SETDIJ:  cpu time      0.7913: real time      0.7933
    TRIAL :  cpu time   1292.7506: real time   1297.9053
    CORREC:  cpu time      0.0068: real time      0.0069
    CHARGE:  cpu time      0.2426: real time      0.2436
    --------------------------------------------
      LOOP:  cpu time   1294.1778: real time   1299.3370

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.6753155E-03  (-0.3353464E-03)
 number of electron      12.0000000 magnetization      -0.0000036
 augmentation part       -0.0020333 magnetization      -0.0000002

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.83318324
  -exchange      EXHF   =        26.48827591
  -V(xc)+E(xc)   XCENC  =       -66.88876909
  PAW double counting   =     78448.98161403   -78368.21632838
  entropy T*S    EENTRO =        -0.00000165
  eigenvalues    EBANDS =       -34.98822525
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94532471 eV

  energy without entropy =      -10.94532306  energy(sigma->0) =      -10.94532416
  exchange ACFDT corr.  =        -0.00058776  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  16)  ---------------------------------------


    POTLOK:  cpu time      0.3863: real time      0.3876
    SETDIJ:  cpu time      0.7906: real time      0.7926
    TRIAL :  cpu time   1291.2615: real time   1296.5154
    CORREC:  cpu time      0.0068: real time      0.0068
    CHARGE:  cpu time      0.2439: real time      0.2449
    --------------------------------------------
      LOOP:  cpu time   1292.6893: real time   1297.9476

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.2394594E-03  (-0.1383874E-03)
 number of electron      12.0000000 magnetization      -0.0000036
 augmentation part       -0.0014609 magnetization      -0.0000002

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.83532059
  -exchange      EXHF   =        26.48850351
  -V(xc)+E(xc)   XCENC  =       -66.88928567
  PAW double counting   =     81069.90720587   -80989.14304159
  entropy T*S    EENTRO =        -0.00004105
  eigenvalues    EBANDS =       -34.98486681
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94556417 eV

  energy without entropy =      -10.94552312  energy(sigma->0) =      -10.94555049
  exchange ACFDT corr.  =        -0.00061288  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  17)  ---------------------------------------


    POTLOK:  cpu time      0.3861: real time      0.3875
    SETDIJ:  cpu time      0.7903: real time      0.7923
    TRIAL :  cpu time   1298.4695: real time   1303.7619
    CORREC:  cpu time      0.0066: real time      0.0066
    CHARGE:  cpu time      0.2434: real time      0.2445
    --------------------------------------------
      LOOP:  cpu time   1299.8962: real time   1305.1931

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1037553E-03  (-0.8044932E-04)
 number of electron      12.0000000 magnetization      -0.0000036
 augmentation part       -0.0012519 magnetization      -0.0000002

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.83953545
  -exchange      EXHF   =        26.48882932
  -V(xc)+E(xc)   XCENC  =       -66.88954033
  PAW double counting   =     82414.65177256   -82333.88822649
  entropy T*S    EENTRO =        -0.00007203
  eigenvalues    EBANDS =       -34.98016925
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94566793 eV

  energy without entropy =      -10.94559590  energy(sigma->0) =      -10.94564392
  exchange ACFDT corr.  =        -0.00063354  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  18)  ---------------------------------------


    POTLOK:  cpu time      0.3859: real time      0.3873
    SETDIJ:  cpu time      0.7904: real time      0.7924
    TRIAL :  cpu time   1291.8885: real time   1297.1212
    CORREC:  cpu time      0.0067: real time      0.0067
    CHARGE:  cpu time      0.2435: real time      0.2445
    --------------------------------------------
      LOOP:  cpu time   1293.3154: real time   1298.5525

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.6718286E-04  (-0.5898332E-04)
 number of electron      12.0000000 magnetization      -0.0000035
 augmentation part       -0.0012429 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.84382735
  -exchange      EXHF   =        26.48918665
  -V(xc)+E(xc)   XCENC  =       -66.88963918
  PAW double counting   =     82943.43467822   -82862.67141677
  entropy T*S    EENTRO =        -0.00009644
  eigenvalues    EBANDS =       -34.97588739
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94573511 eV

  energy without entropy =      -10.94563867  energy(sigma->0) =      -10.94570296
  exchange ACFDT corr.  =        -0.00065057  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  19)  ---------------------------------------


    POTLOK:  cpu time      0.3861: real time      0.3874
    SETDIJ:  cpu time      0.7902: real time      0.7922
    TRIAL :  cpu time   1291.0893: real time   1296.3571
    CORREC:  cpu time      0.0067: real time      0.0067
    CHARGE:  cpu time      0.2426: real time      0.2438
    --------------------------------------------
      LOOP:  cpu time   1292.5152: real time   1297.7876

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.5257182E-04  (-0.4426361E-04)
 number of electron      12.0000000 magnetization      -0.0000034
 augmentation part       -0.0013272 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.84691681
  -exchange      EXHF   =        26.48951979
  -V(xc)+E(xc)   XCENC  =       -66.88967962
  PAW double counting   =     83017.40363641   -82936.64047666
  entropy T*S    EENTRO =        -0.00011576
  eigenvalues    EBANDS =       -34.97301709
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94578768 eV

  energy without entropy =      -10.94567192  energy(sigma->0) =      -10.94574909
  exchange ACFDT corr.  =        -0.00066463  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  20)  ---------------------------------------


    POTLOK:  cpu time      0.3876: real time      0.3893
    SETDIJ:  cpu time      0.7898: real time      0.7921
    TRIAL :  cpu time   1288.4734: real time   1293.6923
    CORREC:  cpu time      0.0066: real time      0.0066
    CHARGE:  cpu time      0.2431: real time      0.2441
    --------------------------------------------
      LOOP:  cpu time   1289.9009: real time   1295.1247

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.4040780E-04  (-0.3171752E-04)
 number of electron      12.0000000 magnetization      -0.0000033
 augmentation part       -0.0014431 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.84893660
  -exchange      EXHF   =        26.48980701
  -V(xc)+E(xc)   XCENC  =       -66.88970681
  PAW double counting   =     82877.78871798   -82797.02560693
  entropy T*S    EENTRO =        -0.00013113
  eigenvalues    EBANDS =       -34.97122973
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94582809 eV

  energy without entropy =      -10.94569696  energy(sigma->0) =      -10.94578438
  exchange ACFDT corr.  =        -0.00067627  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  21)  ---------------------------------------


    POTLOK:  cpu time      0.3862: real time      0.3875
    SETDIJ:  cpu time      0.7909: real time      0.7929
    TRIAL :  cpu time   1291.9393: real time   1297.2055
    CORREC:  cpu time      0.0066: real time      0.0067
    CHARGE:  cpu time      0.2422: real time      0.2432
    --------------------------------------------
      LOOP:  cpu time   1293.3655: real time   1298.6361

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.2924236E-04  (-0.2162380E-04)
 number of electron      12.0000000 magnetization      -0.0000032
 augmentation part       -0.0015580 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.85051825
  -exchange      EXHF   =        26.49004934
  -V(xc)+E(xc)   XCENC  =       -66.88972984
  PAW double counting   =     82661.97818699   -82581.21508332
  entropy T*S    EENTRO =        -0.00014341
  eigenvalues    EBANDS =       -34.96987388
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94585733 eV

  energy without entropy =      -10.94571392  energy(sigma->0) =      -10.94580953
  exchange ACFDT corr.  =        -0.00068595  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  22)  ---------------------------------------


    POTLOK:  cpu time      0.3859: real time      0.3873
    SETDIJ:  cpu time      0.7925: real time      0.7945
    TRIAL :  cpu time   1291.9700: real time   1297.2605
    CORREC:  cpu time      0.0069: real time      0.0070
    CHARGE:  cpu time      0.2423: real time      0.2433
    --------------------------------------------
      LOOP:  cpu time   1293.3983: real time   1298.6933

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.2012304E-04  (-0.1419113E-04)
 number of electron      12.0000000 magnetization      -0.0000031
 augmentation part       -0.0016557 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.85202826
  -exchange      EXHF   =        26.49025400
  -V(xc)+E(xc)   XCENC  =       -66.88974619
  PAW double counting   =     82442.34705682   -82361.58392373
  entropy T*S    EENTRO =        -0.00015328
  eigenvalues    EBANDS =       -34.96858945
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94587746 eV

  energy without entropy =      -10.94572418  energy(sigma->0) =      -10.94582636
  exchange ACFDT corr.  =        -0.00069404  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  23)  ---------------------------------------


    POTLOK:  cpu time      0.3858: real time      0.3871
    SETDIJ:  cpu time      0.7901: real time      0.7922
    TRIAL :  cpu time   1294.8296: real time   1300.1124
    CORREC:  cpu time      0.0069: real time      0.0069
    CHARGE:  cpu time      0.2445: real time      0.2455
    --------------------------------------------
      LOOP:  cpu time   1296.2572: real time   1301.5445

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1334240E-04  (-0.9160153E-05)
 number of electron      12.0000000 magnetization      -0.0000030
 augmentation part       -0.0017311 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.85345055
  -exchange      EXHF   =        26.49042810
  -V(xc)+E(xc)   XCENC  =       -66.88975404
  PAW double counting   =     82254.77029575   -82174.00715257
  entropy T*S    EENTRO =        -0.00016124
  eigenvalues    EBANDS =       -34.96734696
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94589080 eV

  energy without entropy =      -10.94572956  energy(sigma->0) =      -10.94583705
  exchange ACFDT corr.  =        -0.00070080  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      1(  24)  ---------------------------------------


    POTLOK:  cpu time      0.3860: real time      0.3874
    SETDIJ:  cpu time      0.7895: real time      0.7915
    TRIAL :  cpu time   1296.3098: real time   1301.6139
    CORREC:  cpu time      0.0066: real time      0.0066
    EDDIAG:  cpu time   1295.4358: real time   1300.7419
    CHARGE:  cpu time      0.2430: real time      0.2440
    --------------------------------------------
      LOOP:  cpu time   2593.1713: real time   2603.7859

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.8759569E-05  (-0.6023184E-05)
 number of electron      12.0000000 magnetization      -0.0000028
 augmentation part       -0.0017861 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.60180960
  -Hartree energ DENC   =      -508.85474384
  -exchange      EXHF   =        26.49070173
  -V(xc)+E(xc)   XCENC  =       -66.88975552
  PAW double counting   =     82111.49095388   -82030.72780188
  entropy T*S    EENTRO =        -0.00016769
  eigenvalues    EBANDS =       -34.96620992
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94589956 eV

  energy without entropy =      -10.94573186  energy(sigma->0) =      -10.94584366
  exchange ACFDT corr.  =        -0.00070648  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------


  average scaling for gradient   2.1353


 average (electrostatic) potential at core
  the test charge radii are     1.0406
  (the norm of the test charge is              1.0000)
       1 -70.4408       2 -70.4059       3 -70.4059       4 -70.4408
 
 
 
 E-fermi :   2.6297     XC(G=0):  -4.7756     alpha+bet : -8.1680

 Fermi energy:         2.6297012101

 spin component 1

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3676      1.00000
      2     -10.0816      1.00000
      3      -8.0137      1.00000
      4      -5.2259      1.00000
      5      -1.9170      1.00000
      6       2.0340      1.00009
      7       4.5350     -0.00000
      8       6.5241     -0.00000
      9       6.7357     -0.00000
     10      10.8469      0.00000
     11      10.8710      0.00000
     12      15.5464      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2926      1.00000
      2     -10.0064      1.00000
      3      -7.9379      1.00000
      4      -5.1485      1.00000
      5      -1.8409      1.00000
      6       2.1097      1.00066
      7       4.5993     -0.00000
      8       6.5869     -0.00000
      9       6.7969     -0.00000
     10      10.8946      0.00000
     11      10.9262      0.00000
     12      13.9337      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2926      1.00000
      2     -10.0064      1.00000
      3      -7.9379      1.00000
      4      -5.1485      1.00000
      5      -1.8409      1.00000
      6       2.1097      1.00066
      7       4.5993     -0.00000
      8       6.5869     -0.00000
      9       6.7969     -0.00000
     10      10.8946      0.00000
     11      10.9262      0.00000
     12      13.9337      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2926      1.00000
      2     -10.0064      1.00000
      3      -7.9379      1.00000
      4      -5.1485      1.00000
      5      -1.8409      1.00000
      6       2.1097      1.00066
      7       4.5993     -0.00000
      8       6.5869     -0.00000
      9       6.7969     -0.00000
     10      10.8946      0.00000
     11      10.9262      0.00000
     12      13.9337      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7807      1.00000
      3      -7.7106      1.00000
      4      -4.9164      1.00000
      5      -1.6129      1.00000
      6       2.3337      1.02757
      7       4.7908     -0.00000
      8       6.7736     -0.00000
      9       6.9780     -0.00000
     10      10.9815      0.00000
     11      11.0844      0.00000
     12      11.9643      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7807      1.00000
      3      -7.7106      1.00000
      4      -4.9164      1.00000
      5      -1.6129      1.00000
      6       2.3337      1.02757
      7       4.7908     -0.00000
      8       6.7736     -0.00000
      9       6.9780     -0.00000
     10      10.9815      0.00000
     11      11.0844      0.00000
     12      11.9643      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7807      1.00000
      3      -7.7106      1.00000
      4      -4.9164      1.00000
      5      -1.6129      1.00000
      6       2.3337      1.02757
      7       4.7908     -0.00000
      8       6.7736     -0.00000
      9       6.9780     -0.00000
     10      10.9815      0.00000
     11      11.0844      0.00000
     12      11.9643      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.4045      1.00000
      3      -7.3317      1.00000
      4      -4.5305      1.00000
      5      -1.2343      1.00000
      6       2.6962      0.24978
      7       5.1050     -0.00000
      8       7.0740     -0.00000
      9       7.2648     -0.00000
     10       9.7634      0.00000
     11      10.6262      0.00000
     12      12.5622      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.4045      1.00000
      3      -7.3317      1.00000
      4      -4.5305      1.00000
      5      -1.2343      1.00000
      6       2.6962      0.24978
      7       5.1050     -0.00000
      8       7.0740     -0.00000
      9       7.2648     -0.00000
     10       9.7634      0.00000
     11      10.6262      0.00000
     12      12.3840      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.4045      1.00000
      3      -7.3317      1.00000
      4      -4.5305      1.00000
      5      -1.2343      1.00000
      6       2.6962      0.24978
      7       5.1050     -0.00000
      8       7.0740     -0.00000
      9       7.2648     -0.00000
     10       9.7634      0.00000
     11      10.6262      0.00000
     12      12.2623      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1670      1.00000
      2      -8.8774      1.00000
      3      -6.8012      1.00000
      4      -3.9917      1.00000
      5      -0.7073      1.00000
      6       3.1799     -0.00039
      7       5.5214     -0.00000
      8       7.2142     -0.00000
      9       7.5900     -0.00000
     10       8.1221     -0.00000
     11       8.6923      0.00000
     12      10.4460      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1670      1.00000
      2      -8.8774      1.00000
      3      -6.8012      1.00000
      4      -3.9917      1.00000
      5      -0.7073      1.00000
      6       3.1799     -0.00039
      7       5.5214     -0.00000
      8       7.2142     -0.00000
      9       7.5900     -0.00000
     10       8.1221     -0.00000
     11       8.6923      0.00000
     12      10.4460      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1670      1.00000
      2      -8.8774      1.00000
      3      -6.8012      1.00000
      4      -3.9917      1.00000
      5      -0.7073      1.00000
      6       3.1799     -0.00039
      7       5.5214     -0.00000
      8       7.2142     -0.00000
      9       7.5900     -0.00000
     10       8.1221     -0.00000
     11       8.6923      0.00000
     12      10.4460      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1992      1.00000
      3      -6.1188      1.00000
      4      -3.3018      1.00000
      5      -0.0381      1.00000
      6       3.7214     -0.00000
      7       5.3942     -0.00000
      8       6.2753     -0.00000
      9       6.6761     -0.00000
     10       8.1068     -0.00000
     11       8.2615      0.00000
     12       8.6278      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1992      1.00000
      3      -6.1188      1.00000
      4      -3.3018      1.00000
      5      -0.0381      1.00000
      6       3.7214     -0.00000
      7       5.3942     -0.00000
      8       6.2753     -0.00000
      9       6.6761     -0.00000
     10       8.1068     -0.00000
     11       8.2615      0.00000
     12       8.6278      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1992      1.00000
      3      -6.1188      1.00000
      4      -3.3018      1.00000
      5      -0.0381      1.00000
      6       3.7214     -0.00000
      7       5.3942     -0.00000
      8       6.2753     -0.00000
      9       6.6761     -0.00000
     10       8.1068     -0.00000
     11       8.2615      0.00000
     12       8.6278      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6639      1.00000
      2      -7.3693      1.00000
      3      -5.2847      1.00000
      4      -2.4659      1.00000
      5       0.7469      1.00000
      6       3.2584     -0.00004
      7       4.4679     -0.00000
      8       5.0035     -0.00000
      9       6.4890     -0.00000
     10       6.9614     -0.00000
     11       8.8299      0.00000
     12      10.6895      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6639      1.00000
      2      -7.3693      1.00000
      3      -5.2847      1.00000
      4      -2.4659      1.00000
      5       0.7469      1.00000
      6       3.2584     -0.00004
      7       4.4679     -0.00000
      8       5.0035     -0.00000
      9       6.4890     -0.00000
     10       6.9614     -0.00000
     11       8.8299      0.00000
     12      10.6821      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6639      1.00000
      2      -7.3693      1.00000
      3      -5.2847      1.00000
      4      -2.4659      1.00000
      5       0.7469      1.00000
      6       3.2584     -0.00004
      7       4.4679     -0.00000
      8       5.0035     -0.00000
      9       6.4890     -0.00000
     10       6.9614     -0.00000
     11       8.8299      0.00000
     12      10.6958      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6848      1.00000
      2      -6.3871      1.00000
      3      -4.3004      1.00000
      4      -1.5040      1.00000
      5       1.1133      1.00000
      6       1.9690      1.00001
      7       2.8436     -0.03035
      8       4.7205     -0.00000
      9       5.5655     -0.00000
     10       7.2781     -0.00000
     11       7.6944     -0.00000
     12      10.2799      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6848      1.00000
      2      -6.3871      1.00000
      3      -4.3004      1.00000
      4      -1.5040      1.00000
      5       1.1133      1.00000
      6       1.9690      1.00001
      7       2.8436     -0.03035
      8       4.7205     -0.00000
      9       5.5655     -0.00000
     10       7.2781     -0.00000
     11       7.6944     -0.00000
     12      10.2803      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6848      1.00000
      2      -6.3871      1.00000
      3      -4.3004      1.00000
      4      -1.5040      1.00000
      5       1.1133      1.00000
      6       1.9690      1.00001
      7       2.8436     -0.03035
      8       4.7205     -0.00000
      9       5.5655     -0.00000
     10       7.2781     -0.00000
     11       7.6944     -0.00000
     12      10.2803      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5528      1.00000
      2      -5.2528      1.00000
      3      -3.1734      1.00000
      4      -0.7622      1.00000
      5      -0.2387      1.00000
      6       1.0144      1.00000
      7       2.8553     -0.03372
      8       3.1183     -0.00158
      9       5.5774     -0.00000
     10       6.5499     -0.00000
     11       8.3152      0.00000
     12       9.9722      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5528      1.00000
      2      -5.2528      1.00000
      3      -3.1734      1.00000
      4      -0.7622      1.00000
      5      -0.2387      1.00000
      6       1.0144      1.00000
      7       2.8553     -0.03372
      8       3.1183     -0.00158
      9       5.5774     -0.00000
     10       6.5499     -0.00000
     11       8.3152      0.00000
     12       9.9718      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5528      1.00000
      2      -5.2528      1.00000
      3      -3.1734      1.00000
      4      -0.7622      1.00000
      5      -0.2387      1.00000
      6       1.0144      1.00000
      7       2.8553     -0.03372
      8       3.1183     -0.00158
      9       5.5774     -0.00000
     10       6.5499     -0.00000
     11       8.3152      0.00000
     12       9.9641      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2678      1.00000
      2      -3.9705      1.00000
      3      -2.2602      1.00000
      4      -1.9667      1.00000
      5      -0.9261      1.00000
      6       0.9220      1.00000
      7       1.5323      1.00000
      8       4.0106     -0.00000
      9       4.1837     -0.00000
     10       6.8802     -0.00000
     11       7.6031     -0.00000
     12       9.8022      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2678      1.00000
      2      -3.9705      1.00000
      3      -2.2602      1.00000
      4      -1.9667      1.00000
      5      -0.9261      1.00000
      6       0.9220      1.00000
      7       1.5323      1.00000
      8       4.0106     -0.00000
      9       4.1837     -0.00000
     10       6.8802     -0.00000
     11       7.6031     -0.00000
     12       9.8022      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2678      1.00000
      2      -3.9705      1.00000
      3      -2.2602      1.00000
      4      -1.9667      1.00000
      5      -0.9261      1.00000
      6       0.9220      1.00000
      7       1.5323      1.00000
      8       4.0106     -0.00000
      9       4.1837     -0.00000
     10       6.8802     -0.00000
     11       7.6031     -0.00000
     12       9.8022      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8639      1.00000
      2      -3.8003      1.00000
      3      -2.6012      1.00000
      4      -2.5227      1.00000
      5      -0.7883      1.00000
      6       0.0637      1.00000
      7       2.3607      1.03375
      8       2.7262      0.14402
      9       5.2657     -0.00000
     10       5.7041     -0.00000
     11       8.4718      0.00000
     12       9.4586      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8639      1.00000
      2      -3.8003      1.00000
      3      -2.6012      1.00000
      4      -2.5227      1.00000
      5      -0.7883      1.00000
      6       0.0637      1.00000
      7       2.3607      1.03375
      8       2.7262      0.14402
      9       5.2657     -0.00000
     10       5.7041     -0.00000
     11       8.4718      0.00000
     12       9.7155      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8639      1.00000
      2      -3.8003      1.00000
      3      -2.6012      1.00000
      4      -2.5227      1.00000
      5      -0.7883      1.00000
      6       0.0637      1.00000
      7       2.3607      1.03375
      8       2.7262      0.14402
      9       5.2657     -0.00000
     10       5.7041     -0.00000
     11       8.4718      0.00000
     12       9.7152      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1425      1.00000
      2      -9.8560      1.00000
      3      -7.7864      1.00000
      4      -4.9938      1.00000
      5      -1.6889      1.00000
      6       2.2596      1.01180
      7       4.7272     -0.00000
      8       6.7117     -0.00000
      9       6.9181     -0.00000
     10      10.9788      0.00000
     11      11.0292      0.00000
     12      12.9537      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1425      1.00000
      2      -9.8560      1.00000
      3      -7.7864      1.00000
      4      -4.9938      1.00000
      5      -1.6889      1.00000
      6       2.2596      1.01180
      7       4.7272     -0.00000
      8       6.7117     -0.00000
      9       6.9182     -0.00000
     10      10.9793      0.00000
     11      11.0285      0.00000
     12      12.9375      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1425      1.00000
      2      -9.8560      1.00000
      3      -7.7864      1.00000
      4      -4.9938      1.00000
      5      -1.6889      1.00000
      6       2.2596      1.01180
      7       4.7272     -0.00000
      8       6.7117     -0.00000
      9       6.9182     -0.00000
     10      10.9799      0.00000
     11      11.0279      0.00000
     12      12.9386      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81367
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1991      0.00000
     12      11.6038      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81367
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1991      0.00000
     12      11.6038      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81367
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1991      0.00000
     12      11.6039      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81367
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1991      0.00000
     12      11.6038      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81367
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1991      0.00000
     12      11.6038      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81367
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1991      0.00000
     12      11.6038      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01782
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0563      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01782
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0563      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01782
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0563      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01782
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0563      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01782
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0563      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01782
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0563      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5045     -0.00000
      7       5.7524     -0.00000
      8       6.6256     -0.00000
      9       7.6712     -0.00000
     10       7.8896     -0.00000
     11       8.1786      0.00000
     12       9.5079      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5046     -0.00000
      7       5.7524     -0.00000
      8       6.6255     -0.00000
      9       7.6711     -0.00000
     10       7.8894     -0.00000
     11       8.1786      0.00000
     12       9.5082      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5045     -0.00000
      7       5.7524     -0.00000
      8       6.6255     -0.00000
      9       7.6711     -0.00000
     10       7.8895     -0.00000
     11       8.1786      0.00000
     12       9.5081      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5045     -0.00000
      7       5.7524     -0.00000
      8       6.6255     -0.00000
      9       7.6711     -0.00000
     10       7.8895     -0.00000
     11       8.1786      0.00000
     12       9.5081      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5045     -0.00000
      7       5.7524     -0.00000
      8       6.6256     -0.00000
      9       7.6712     -0.00000
     10       7.8896     -0.00000
     11       8.1786      0.00000
     12       9.5079      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5046     -0.00000
      7       5.7524     -0.00000
      8       6.6255     -0.00000
      9       7.6710     -0.00000
     10       7.8894     -0.00000
     11       8.1786      0.00000
     12       9.5083      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5512     -0.00000
     10       7.5704     -0.00000
     11       8.4407      0.00000
     12       9.4372      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5512     -0.00000
     10       7.5704     -0.00000
     11       8.4407      0.00000
     12       9.4371      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5512     -0.00000
     10       7.5704     -0.00000
     11       8.4407      0.00000
     12       9.4372      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5512     -0.00000
     10       7.5704     -0.00000
     11       8.4407      0.00000
     12       9.4371      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5512     -0.00000
     10       7.5704     -0.00000
     11       8.4407      0.00000
     12       9.4373      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5512     -0.00000
     10       7.5704     -0.00000
     11       8.4407      0.00000
     12       9.4373      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66034
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7682      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66036
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7682      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66034
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7682      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66034
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7682      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66034
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7682      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66036
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7682      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4672      1.00000
      2      -9.1786      1.00000
      3      -7.1044      1.00000
      4      -4.2994      1.00000
      5      -1.0078      1.00000
      6       2.9082     -0.03272
      7       5.2910     -0.00000
      8       7.2525     -0.00000
      9       7.4281     -0.00000
     10       9.9245      0.00000
     11       9.9258      0.00000
     12      10.7963      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4672      1.00000
      2      -9.1786      1.00000
      3      -7.1044      1.00000
      4      -4.2994      1.00000
      5      -1.0078      1.00000
      6       2.9082     -0.03272
      7       5.2910     -0.00000
      8       7.2525     -0.00000
      9       7.4281     -0.00000
     10       9.9245      0.00000
     11       9.9258      0.00000
     12      10.8078      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4672      1.00000
      2      -9.1786      1.00000
      3      -7.1044      1.00000
      4      -4.2994      1.00000
      5      -1.0078      1.00000
      6       2.9082     -0.03272
      7       5.2910     -0.00000
      8       7.2524     -0.00000
      9       7.4281     -0.00000
     10       9.9245      0.00000
     11       9.9258      0.00000
     12      10.8194      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6990     -0.00000
     10       8.2860      0.00000
     11       8.8475      0.00000
     12       9.2113      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6990     -0.00000
     10       8.2860      0.00000
     11       8.8475      0.00000
     12       9.2112      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6990     -0.00000
     10       8.2860      0.00000
     11       8.8475      0.00000
     12       9.2113      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6990     -0.00000
     10       8.2860      0.00000
     11       8.8475      0.00000
     12       9.2113      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6990     -0.00000
     10       8.2860      0.00000
     11       8.8477      0.00000
     12       9.2110      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6990     -0.00000
     10       8.2860      0.00000
     11       8.8475      0.00000
     12       9.2113      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4818      0.00000
     12       8.8614      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4818      0.00000
     12       8.8614      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4818      0.00000
     12       8.8614      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4818      0.00000
     12       8.8614      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4818      0.00000
     12       8.8614      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4818      0.00000
     12       8.8614      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9656      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9657      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9656      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9656      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9656      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9657      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6656     -0.00000
     10       7.0821     -0.00000
     11       7.4697     -0.00000
     12       8.4276      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6656     -0.00000
     10       7.0821     -0.00000
     11       7.4697     -0.00000
     12       8.4276      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6656     -0.00000
     10       7.0821     -0.00000
     11       7.4697     -0.00000
     12       8.4276      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6656     -0.00000
     10       7.0821     -0.00000
     11       7.4697     -0.00000
     12       8.4276      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6656     -0.00000
     10       7.0821     -0.00000
     11       7.4697     -0.00000
     12       8.4276      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6656     -0.00000
     10       7.0821     -0.00000
     11       7.4697     -0.00000
     12       8.4276      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2551      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2551      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2551      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2551      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2551      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2551      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6376      1.00000
      2      -3.5716      1.00000
      3      -2.3735      1.00000
      4      -2.3019      1.00000
      5      -0.5720      1.00000
      6       0.2890      1.00000
      7       2.5567      0.78359
      8       2.9134     -0.03140
      9       5.3731     -0.00000
     10       5.8851     -0.00000
     11       6.6886     -0.00000
     12       7.8444     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6376      1.00000
      2      -3.5716      1.00000
      3      -2.3735      1.00000
      4      -2.3019      1.00000
      5      -0.5720      1.00000
      6       0.2890      1.00000
      7       2.5567      0.78360
      8       2.9134     -0.03140
      9       5.3731     -0.00000
     10       5.8851     -0.00000
     11       6.6886     -0.00000
     12       7.8444     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6376      1.00000
      2      -3.5716      1.00000
      3      -2.3735      1.00000
      4      -2.3019      1.00000
      5      -0.5720      1.00000
      6       0.2890      1.00000
      7       2.5567      0.78359
      8       2.9134     -0.03140
      9       5.3731     -0.00000
     10       5.8851     -0.00000
     11       6.6886     -0.00000
     12       7.8444     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -8.0485      1.00000
      3      -5.9672      1.00000
      4      -3.1488      1.00000
      5       0.1122      1.00000
      6       3.8853     -0.00000
      7       6.0400     -0.00000
      8       6.9797     -0.00000
      9       7.0159     -0.00000
     10       8.0031     -0.00000
     11       8.0904     -0.00000
     12       8.8113      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -8.0485      1.00000
      3      -5.9672      1.00000
      4      -3.1488      1.00000
      5       0.1122      1.00000
      6       3.8853     -0.00000
      7       6.0400     -0.00000
      8       6.9797     -0.00000
      9       7.0159     -0.00000
     10       8.0031     -0.00000
     11       8.0904     -0.00000
     12       8.8113      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -8.0485      1.00000
      3      -5.9672      1.00000
      4      -3.1488      1.00000
      5       0.1122      1.00000
      6       3.8853     -0.00000
      7       6.0400     -0.00000
      8       6.9797     -0.00000
      9       7.0159     -0.00000
     10       8.0031     -0.00000
     11       8.0904     -0.00000
     12       8.8113      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63268
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63269
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63268
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63268
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63268
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63269
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7600      1.00000
      2      -6.4629      1.00000
      3      -4.3757      1.00000
      4      -1.5638      1.00000
      5       1.5900      1.00000
      6       4.0026     -0.00000
      7       4.2200     -0.00000
      8       5.2316     -0.00000
      9       5.4339     -0.00000
     10       5.9979     -0.00000
     11       7.1118     -0.00000
     12       7.4399     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7600      1.00000
      2      -6.4629      1.00000
      3      -4.3757      1.00000
      4      -1.5638      1.00000
      5       1.5900      1.00000
      6       4.0026     -0.00000
      7       4.2200     -0.00000
      8       5.2316     -0.00000
      9       5.4339     -0.00000
     10       5.9979     -0.00000
     11       7.1118     -0.00000
     12       7.4399     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7600      1.00000
      2      -6.4629      1.00000
      3      -4.3757      1.00000
      4      -1.5638      1.00000
      5       1.5900      1.00000
      6       4.0026     -0.00000
      7       4.2200     -0.00000
      8       5.2316     -0.00000
      9       5.4339     -0.00000
     10       5.9979     -0.00000
     11       7.1118     -0.00000
     12       7.4399     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09071
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09072
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09072
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09072
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09071
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09072
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01038
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9596      1.00000
      2      -2.8868      1.00000
      3      -1.6932      1.00000
      4      -1.6411      1.00000
      5       0.0696      1.00000
      6       0.9449      1.00000
      7       2.7152      0.17965
      8       2.9329     -0.02696
      9       3.8763     -0.00000
     10       4.7360     -0.00000
     11       6.1553     -0.00000
     12       6.5065     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9596      1.00000
      2      -2.8868      1.00000
      3      -1.6932      1.00000
      4      -1.6411      1.00000
      5       0.0696      1.00000
      6       0.9449      1.00000
      7       2.7152      0.17965
      8       2.9329     -0.02696
      9       3.8763     -0.00000
     10       4.7360     -0.00000
     11       6.1553     -0.00000
     12       6.5065     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9596      1.00000
      2      -2.8868      1.00000
      3      -1.6932      1.00000
      4      -1.6411      1.00000
      5       0.0696      1.00000
      6       0.9449      1.00000
      7       2.7152      0.17965
      8       2.9329     -0.02696
      9       3.8763     -0.00000
     10       4.7360     -0.00000
     11       6.1553     -0.00000
     12       6.5065     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7201      1.00000
      2      -4.4211      1.00000
      3      -2.3468      1.00000
      4       0.2998      1.00000
      5       1.5952      1.00000
      6       1.9067      1.00000
      7       2.9599     -0.02091
      8       3.2306     -0.00009
      9       4.0119     -0.00000
     10       4.8202     -0.00000
     11       5.6496     -0.00000
     12       7.2626     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7201      1.00000
      2      -4.4211      1.00000
      3      -2.3468      1.00000
      4       0.2998      1.00000
      5       1.5952      1.00000
      6       1.9067      1.00000
      7       2.9599     -0.02091
      8       3.2306     -0.00009
      9       4.0119     -0.00000
     10       4.8202     -0.00000
     11       5.6496     -0.00000
     12       7.2626     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7201      1.00000
      2      -4.4211      1.00000
      3      -2.3468      1.00000
      4       0.2998      1.00000
      5       1.5952      1.00000
      6       1.9067      1.00000
      7       2.9599     -0.02091
      8       3.2306     -0.00009
      9       4.0119     -0.00000
     10       4.8202     -0.00000
     11       5.6496     -0.00000
     12       7.2626     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05091
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05091
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05091
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05091
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05091
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05091
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2231      1.00000
      2      -1.9451      1.00000
      3      -0.2833      1.00000
      4      -0.2031      1.00000
      5      -0.0546      1.00000
      6       0.8644      1.00000
      7       1.2167      1.00000
      8       2.4944      0.95211
      9       3.6862     -0.00000
     10       3.8445     -0.00000
     11       5.9783     -0.00000
     12       6.2044     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2231      1.00000
      2      -1.9451      1.00000
      3      -0.2833      1.00000
      4      -0.2031      1.00000
      5      -0.0546      1.00000
      6       0.8644      1.00000
      7       1.2167      1.00000
      8       2.4944      0.95211
      9       3.6862     -0.00000
     10       3.8445     -0.00000
     11       5.9783     -0.00000
     12       6.2072     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2231      1.00000
      2      -1.9451      1.00000
      3      -0.2833      1.00000
      4      -0.2031      1.00000
      5      -0.0546      1.00000
      6       0.8644      1.00000
      7       1.2167      1.00000
      8       2.4944      0.95211
      9       3.6862     -0.00000
     10       3.8445     -0.00000
     11       5.9784     -0.00000
     12       6.2030     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8362      1.00000
      2      -1.7530      1.00000
      3      -0.5765      1.00000
      4      -0.5593      1.00000
      5      -0.3062      1.00000
      6       0.6735      1.00000
      7       1.4279      1.00000
      8       1.8071      1.00000
      9       3.4851     -0.00000
     10       4.5840     -0.00000
     11       4.8565     -0.00000
     12       6.0311     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8362      1.00000
      2      -1.7530      1.00000
      3      -0.5765      1.00000
      4      -0.5593      1.00000
      5      -0.3062      1.00000
      6       0.6735      1.00000
      7       1.4279      1.00000
      8       1.8071      1.00000
      9       3.4851     -0.00000
     10       4.5840     -0.00000
     11       4.8565     -0.00000
     12       6.0311     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8362      1.00000
      2      -1.7530      1.00000
      3      -0.5765      1.00000
      4      -0.5593      1.00000
      5      -0.3062      1.00000
      6       0.6735      1.00000
      7       1.4279      1.00000
      8       1.8071      1.00000
      9       3.4851     -0.00000
     10       4.5840     -0.00000
     11       4.8565     -0.00000
     12       6.0311     -0.00000
 Fermi energy:         2.6297012101

 spin component 2

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3676      1.00000
      2     -10.0816      1.00000
      3      -8.0137      1.00000
      4      -5.2259      1.00000
      5      -1.9170      1.00000
      6       2.0340      1.00009
      7       4.5350     -0.00000
      8       6.5241     -0.00000
      9       6.7356     -0.00000
     10      10.8469      0.00000
     11      10.8710      0.00000
     12      15.5464      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2926      1.00000
      2     -10.0064      1.00000
      3      -7.9379      1.00000
      4      -5.1485      1.00000
      5      -1.8409      1.00000
      6       2.1097      1.00066
      7       4.5993     -0.00000
      8       6.5869     -0.00000
      9       6.7969     -0.00000
     10      10.8946      0.00000
     11      10.9262      0.00000
     12      13.9337      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2926      1.00000
      2     -10.0064      1.00000
      3      -7.9379      1.00000
      4      -5.1485      1.00000
      5      -1.8409      1.00000
      6       2.1097      1.00066
      7       4.5993     -0.00000
      8       6.5869     -0.00000
      9       6.7969     -0.00000
     10      10.8946      0.00000
     11      10.9262      0.00000
     12      13.9337      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2926      1.00000
      2     -10.0064      1.00000
      3      -7.9379      1.00000
      4      -5.1485      1.00000
      5      -1.8409      1.00000
      6       2.1097      1.00066
      7       4.5993     -0.00000
      8       6.5869     -0.00000
      9       6.7969     -0.00000
     10      10.8946      0.00000
     11      10.9262      0.00000
     12      13.9337      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7807      1.00000
      3      -7.7106      1.00000
      4      -4.9164      1.00000
      5      -1.6129      1.00000
      6       2.3337      1.02757
      7       4.7908     -0.00000
      8       6.7736     -0.00000
      9       6.9780     -0.00000
     10      10.9815      0.00000
     11      11.0844      0.00000
     12      11.9643      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7807      1.00000
      3      -7.7106      1.00000
      4      -4.9164      1.00000
      5      -1.6129      1.00000
      6       2.3337      1.02757
      7       4.7908     -0.00000
      8       6.7736     -0.00000
      9       6.9780     -0.00000
     10      10.9815      0.00000
     11      11.0844      0.00000
     12      11.9643      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7807      1.00000
      3      -7.7106      1.00000
      4      -4.9164      1.00000
      5      -1.6129      1.00000
      6       2.3337      1.02757
      7       4.7908     -0.00000
      8       6.7736     -0.00000
      9       6.9780     -0.00000
     10      10.9815      0.00000
     11      11.0844      0.00000
     12      11.9643      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.4045      1.00000
      3      -7.3317      1.00000
      4      -4.5305      1.00000
      5      -1.2343      1.00000
      6       2.6962      0.24984
      7       5.1050     -0.00000
      8       7.0740     -0.00000
      9       7.2648     -0.00000
     10       9.7634      0.00000
     11      10.6262      0.00000
     12      12.3010      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.4045      1.00000
      3      -7.3317      1.00000
      4      -4.5305      1.00000
      5      -1.2343      1.00000
      6       2.6962      0.24984
      7       5.1050     -0.00000
      8       7.0740     -0.00000
      9       7.2648     -0.00000
     10       9.7634      0.00000
     11      10.6262      0.00000
     12      12.1390      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.4045      1.00000
      3      -7.3317      1.00000
      4      -4.5305      1.00000
      5      -1.2343      1.00000
      6       2.6962      0.24984
      7       5.1050     -0.00000
      8       7.0740     -0.00000
      9       7.2648     -0.00000
     10       9.7634      0.00000
     11      10.6262      0.00000
     12      12.5323      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1670      1.00000
      2      -8.8774      1.00000
      3      -6.8012      1.00000
      4      -3.9917      1.00000
      5      -0.7073      1.00000
      6       3.1798     -0.00039
      7       5.5214     -0.00000
      8       7.2142     -0.00000
      9       7.5900     -0.00000
     10       8.1221     -0.00000
     11       8.6923      0.00000
     12      10.4460      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1670      1.00000
      2      -8.8774      1.00000
      3      -6.8012      1.00000
      4      -3.9917      1.00000
      5      -0.7073      1.00000
      6       3.1798     -0.00039
      7       5.5214     -0.00000
      8       7.2142     -0.00000
      9       7.5900     -0.00000
     10       8.1221     -0.00000
     11       8.6923      0.00000
     12      10.4460      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1670      1.00000
      2      -8.8774      1.00000
      3      -6.8012      1.00000
      4      -3.9917      1.00000
      5      -0.7073      1.00000
      6       3.1798     -0.00039
      7       5.5214     -0.00000
      8       7.2142     -0.00000
      9       7.5900     -0.00000
     10       8.1221     -0.00000
     11       8.6923      0.00000
     12      10.4460      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1992      1.00000
      3      -6.1188      1.00000
      4      -3.3018      1.00000
      5      -0.0381      1.00000
      6       3.7214     -0.00000
      7       5.3942     -0.00000
      8       6.2753     -0.00000
      9       6.6761     -0.00000
     10       8.1068     -0.00000
     11       8.2615      0.00000
     12       8.6278      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1992      1.00000
      3      -6.1188      1.00000
      4      -3.3018      1.00000
      5      -0.0381      1.00000
      6       3.7214     -0.00000
      7       5.3942     -0.00000
      8       6.2753     -0.00000
      9       6.6761     -0.00000
     10       8.1068     -0.00000
     11       8.2615      0.00000
     12       8.6278      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1992      1.00000
      3      -6.1188      1.00000
      4      -3.3018      1.00000
      5      -0.0381      1.00000
      6       3.7214     -0.00000
      7       5.3942     -0.00000
      8       6.2753     -0.00000
      9       6.6761     -0.00000
     10       8.1068     -0.00000
     11       8.2615      0.00000
     12       8.6278      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6639      1.00000
      2      -7.3693      1.00000
      3      -5.2847      1.00000
      4      -2.4659      1.00000
      5       0.7469      1.00000
      6       3.2584     -0.00004
      7       4.4679     -0.00000
      8       5.0035     -0.00000
      9       6.4890     -0.00000
     10       6.9615     -0.00000
     11       8.8302      0.00000
     12      10.4040      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6639      1.00000
      2      -7.3693      1.00000
      3      -5.2847      1.00000
      4      -2.4659      1.00000
      5       0.7469      1.00000
      6       3.2584     -0.00004
      7       4.4679     -0.00000
      8       5.0035     -0.00000
      9       6.4890     -0.00000
     10       6.9614     -0.00000
     11       8.8302      0.00000
     12      10.6346      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6639      1.00000
      2      -7.3693      1.00000
      3      -5.2847      1.00000
      4      -2.4659      1.00000
      5       0.7469      1.00000
      6       3.2584     -0.00004
      7       4.4679     -0.00000
      8       5.0035     -0.00000
      9       6.4890     -0.00000
     10       6.9615     -0.00000
     11       8.8301      0.00000
     12      10.5276      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6848      1.00000
      2      -6.3871      1.00000
      3      -4.3004      1.00000
      4      -1.5040      1.00000
      5       1.1133      1.00000
      6       1.9690      1.00001
      7       2.8436     -0.03035
      8       4.7205     -0.00000
      9       5.5655     -0.00000
     10       7.2781     -0.00000
     11       7.6944     -0.00000
     12      10.2792      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6848      1.00000
      2      -6.3871      1.00000
      3      -4.3004      1.00000
      4      -1.5040      1.00000
      5       1.1133      1.00000
      6       1.9690      1.00001
      7       2.8436     -0.03035
      8       4.7205     -0.00000
      9       5.5655     -0.00000
     10       7.2781     -0.00000
     11       7.6944     -0.00000
     12      10.2803      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6848      1.00000
      2      -6.3871      1.00000
      3      -4.3004      1.00000
      4      -1.5040      1.00000
      5       1.1133      1.00000
      6       1.9690      1.00001
      7       2.8436     -0.03035
      8       4.7205     -0.00000
      9       5.5655     -0.00000
     10       7.2781     -0.00000
     11       7.6944     -0.00000
     12      10.2803      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5528      1.00000
      2      -5.2528      1.00000
      3      -3.1734      1.00000
      4      -0.7622      1.00000
      5      -0.2387      1.00000
      6       1.0144      1.00000
      7       2.8553     -0.03372
      8       3.1183     -0.00158
      9       5.5774     -0.00000
     10       6.5499     -0.00000
     11       8.3152      0.00000
     12       9.9413      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5528      1.00000
      2      -5.2528      1.00000
      3      -3.1734      1.00000
      4      -0.7622      1.00000
      5      -0.2387      1.00000
      6       1.0144      1.00000
      7       2.8553     -0.03372
      8       3.1183     -0.00158
      9       5.5774     -0.00000
     10       6.5499     -0.00000
     11       8.3152      0.00000
     12       9.9590      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5528      1.00000
      2      -5.2528      1.00000
      3      -3.1734      1.00000
      4      -0.7622      1.00000
      5      -0.2387      1.00000
      6       1.0144      1.00000
      7       2.8553     -0.03372
      8       3.1183     -0.00158
      9       5.5774     -0.00000
     10       6.5499     -0.00000
     11       8.3152      0.00000
     12       9.9591      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2678      1.00000
      2      -3.9705      1.00000
      3      -2.2602      1.00000
      4      -1.9667      1.00000
      5      -0.9261      1.00000
      6       0.9220      1.00000
      7       1.5323      1.00000
      8       4.0106     -0.00000
      9       4.1837     -0.00000
     10       6.8802     -0.00000
     11       7.6031     -0.00000
     12       9.8022      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2678      1.00000
      2      -3.9705      1.00000
      3      -2.2602      1.00000
      4      -1.9667      1.00000
      5      -0.9261      1.00000
      6       0.9220      1.00000
      7       1.5323      1.00000
      8       4.0106     -0.00000
      9       4.1837     -0.00000
     10       6.8802     -0.00000
     11       7.6031     -0.00000
     12       9.8022      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2678      1.00000
      2      -3.9705      1.00000
      3      -2.2602      1.00000
      4      -1.9667      1.00000
      5      -0.9261      1.00000
      6       0.9220      1.00000
      7       1.5323      1.00000
      8       4.0106     -0.00000
      9       4.1837     -0.00000
     10       6.8802     -0.00000
     11       7.6031     -0.00000
     12       9.8022      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8639      1.00000
      2      -3.8003      1.00000
      3      -2.6012      1.00000
      4      -2.5227      1.00000
      5      -0.7883      1.00000
      6       0.0637      1.00000
      7       2.3607      1.03375
      8       2.7262      0.14402
      9       5.2657     -0.00000
     10       5.7041     -0.00000
     11       8.4718      0.00000
     12       9.5855      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8639      1.00000
      2      -3.8003      1.00000
      3      -2.6012      1.00000
      4      -2.5227      1.00000
      5      -0.7883      1.00000
      6       0.0637      1.00000
      7       2.3607      1.03375
      8       2.7262      0.14402
      9       5.2657     -0.00000
     10       5.7041     -0.00000
     11       8.4718      0.00000
     12       9.7301      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8639      1.00000
      2      -3.8003      1.00000
      3      -2.6012      1.00000
      4      -2.5227      1.00000
      5      -0.7883      1.00000
      6       0.0637      1.00000
      7       2.3607      1.03375
      8       2.7262      0.14403
      9       5.2656     -0.00000
     10       5.7041     -0.00000
     11       8.4718      0.00000
     12       9.0337      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1425      1.00000
      2      -9.8560      1.00000
      3      -7.7864      1.00000
      4      -4.9938      1.00000
      5      -1.6889      1.00000
      6       2.2596      1.01180
      7       4.7272     -0.00000
      8       6.7117     -0.00000
      9       6.9182     -0.00000
     10      10.9778      0.00000
     11      11.0300      0.00000
     12      12.9342      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1425      1.00000
      2      -9.8560      1.00000
      3      -7.7864      1.00000
      4      -4.9938      1.00000
      5      -1.6889      1.00000
      6       2.2596      1.01180
      7       4.7272     -0.00000
      8       6.7117     -0.00000
      9       6.9182     -0.00000
     10      10.9778      0.00000
     11      11.0300      0.00000
     12      12.9355      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1425      1.00000
      2      -9.8560      1.00000
      3      -7.7864      1.00000
      4      -4.9938      1.00000
      5      -1.6889      1.00000
      6       2.2596      1.01180
      7       4.7272     -0.00000
      8       6.7117     -0.00000
      9       6.9182     -0.00000
     10      10.9778      0.00000
     11      11.0300      0.00000
     12      12.9429      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81373
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1956      0.00000
     12      11.5520      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81373
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1956      0.00000
     12      11.5520      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81373
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1956      0.00000
     12      11.5521      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81373
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1956      0.00000
     12      11.5521      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81373
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1956      0.00000
     12      11.5520      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8425      1.00000
      2      -9.5550      1.00000
      3      -7.4833      1.00000
      4      -4.6848      1.00000
      5      -1.3855      1.00000
      6       2.5529      0.81373
      7       4.9804     -0.00000
      8       6.9571     -0.00000
      9       7.1539     -0.00000
     10      10.7181      0.00000
     11      11.1956      0.00000
     12      11.5520      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01783
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0564      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01783
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0564      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01783
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0564      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01783
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0564      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01783
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0564      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.1033      1.00000
      3      -7.0286      1.00000
      4      -4.2224      1.00000
      5      -0.9325      1.00000
      6       2.9770     -0.01783
      7       5.3502     -0.00000
      8       7.2898     -0.00000
      9       7.4683     -0.00000
     10       8.8557      0.00000
     11       9.7220      0.00000
     12      11.0564      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5045     -0.00000
      7       5.7524     -0.00000
      8       6.6255     -0.00000
      9       7.6710     -0.00000
     10       7.8893     -0.00000
     11       8.1785      0.00000
     12       9.5083      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5045     -0.00000
      7       5.7524     -0.00000
      8       6.6255     -0.00000
      9       7.6710     -0.00000
     10       7.8893     -0.00000
     11       8.1785      0.00000
     12       9.5083      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5045     -0.00000
      7       5.7524     -0.00000
      8       6.6255     -0.00000
      9       7.6710     -0.00000
     10       7.8893     -0.00000
     11       8.1785      0.00000
     12       9.5083      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5045     -0.00000
      7       5.7524     -0.00000
      8       6.6255     -0.00000
      9       7.6710     -0.00000
     10       7.8893     -0.00000
     11       8.1785      0.00000
     12       9.5083      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5045     -0.00000
      7       5.7524     -0.00000
      8       6.6255     -0.00000
      9       7.6710     -0.00000
     10       7.8893     -0.00000
     11       8.1785      0.00000
     12       9.5083      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.5008      1.00000
      3      -6.4222      1.00000
      4      -3.6079      1.00000
      5      -0.3336      1.00000
      6       3.5045     -0.00000
      7       5.7524     -0.00000
      8       6.6255     -0.00000
      9       7.6710     -0.00000
     10       7.8893     -0.00000
     11       8.1785      0.00000
     12       9.5083      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5513     -0.00000
     10       7.5704     -0.00000
     11       8.4411      0.00000
     12       9.3979      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5513     -0.00000
     10       7.5704     -0.00000
     11       8.4411      0.00000
     12       9.3982      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5513     -0.00000
     10       7.5704     -0.00000
     11       8.4411      0.00000
     12       9.3966      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5513     -0.00000
     10       7.5704     -0.00000
     11       8.4411      0.00000
     12       9.3968      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5513     -0.00000
     10       7.5704     -0.00000
     11       8.4411      0.00000
     12       9.3980      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.7467      1.00000
      3      -5.6639      1.00000
      4      -2.8444      1.00000
      5       0.3994      1.00000
      6       3.8693     -0.00000
      7       4.7714     -0.00000
      8       5.7661     -0.00000
      9       6.5513     -0.00000
     10       7.5704     -0.00000
     11       8.4411      0.00000
     12       9.3951      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1369      1.00000
      2      -6.8406      1.00000
      3      -4.7543      1.00000
      4      -1.9413      1.00000
      5       1.1811      1.00000
      6       2.4921      0.95756
      7       3.7477     -0.00000
      8       5.2012     -0.00000
      9       5.6832     -0.00000
     10       7.3083     -0.00000
     11       8.1319     -0.00000
     12       8.9716      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66034
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7681      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66033
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7681      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66034
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7681      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66034
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7681      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66034
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7681      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0813      1.00000
      2      -5.7821      1.00000
      3      -3.6971      1.00000
      4      -0.9541      1.00000
      5       0.4445      1.00000
      6       1.7906      1.00000
      7       2.5933      0.66033
      8       3.8952     -0.00000
      9       5.9833     -0.00000
     10       6.5421     -0.00000
     11       8.1085     -0.00000
     12       8.7681      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8725      1.00000
      2      -4.5729      1.00000
      3      -2.5104      1.00000
      4      -1.3872      1.00000
      5      -0.2771      1.00000
      6       0.7322      1.00000
      7       2.1970      1.00451
      8       3.6196     -0.00000
      9       4.8410     -0.00000
     10       7.0320     -0.00000
     11       7.6539     -0.00000
     12       8.5449      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5119      1.00000
      2      -3.2225      1.00000
      3      -3.0039      1.00000
      4      -1.8263      1.00000
      5      -1.0737      1.00000
      6       0.5324      1.00000
      7       1.9115      1.00000
      8       3.3321     -0.00001
      9       4.8322     -0.00000
     10       6.2452     -0.00000
     11       7.9846     -0.00000
     12       8.4858      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4672      1.00000
      2      -9.1786      1.00000
      3      -7.1044      1.00000
      4      -4.2994      1.00000
      5      -1.0078      1.00000
      6       2.9082     -0.03272
      7       5.2910     -0.00000
      8       7.2525     -0.00000
      9       7.4281     -0.00000
     10       9.9245      0.00000
     11       9.9258      0.00000
     12      10.7909      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4672      1.00000
      2      -9.1786      1.00000
      3      -7.1044      1.00000
      4      -4.2994      1.00000
      5      -1.0078      1.00000
      6       2.9082     -0.03272
      7       5.2910     -0.00000
      8       7.2525     -0.00000
      9       7.4281     -0.00000
     10       9.9245      0.00000
     11       9.9258      0.00000
     12      10.7915      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4672      1.00000
      2      -9.1786      1.00000
      3      -7.1044      1.00000
      4      -4.2994      1.00000
      5      -1.0078      1.00000
      6       2.9082     -0.03272
      7       5.2910     -0.00000
      8       7.2525     -0.00000
      9       7.4281     -0.00000
     10       9.9245      0.00000
     11       9.9258      0.00000
     12      10.8002      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6989     -0.00000
     10       8.2860      0.00000
     11       8.8469      0.00000
     12       9.2114      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6989     -0.00000
     10       8.2860      0.00000
     11       8.8469      0.00000
     12       9.2114      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6989     -0.00000
     10       8.2860      0.00000
     11       8.8469      0.00000
     12       9.2114      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6989     -0.00000
     10       8.2860      0.00000
     11       8.8469      0.00000
     12       9.2114      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6989     -0.00000
     10       8.2860      0.00000
     11       8.8469      0.00000
     12       9.2114      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9417      1.00000
      2      -8.6515      1.00000
      3      -6.5738      1.00000
      4      -3.7613      1.00000
      5      -0.4822      1.00000
      6       3.3831     -0.00000
      7       5.7010     -0.00000
      8       7.4070     -0.00000
      9       7.6989     -0.00000
     10       8.2860      0.00000
     11       8.8469      0.00000
     12       9.2114      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4823      0.00000
     12       8.8915      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4823      0.00000
     12       8.8915      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4823      0.00000
     12       8.8915      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4823      0.00000
     12       8.8915      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4823      0.00000
     12       8.8915      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9730      1.00000
      3      -5.8914      1.00000
      4      -3.0725      1.00000
      5       0.1846      1.00000
      6       3.9161     -0.00000
      7       5.5834     -0.00000
      8       6.4450     -0.00000
      9       6.8588     -0.00000
     10       7.9969     -0.00000
     11       8.4823      0.00000
     12       8.8915      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9656      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9656      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9656      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9656      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9656      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4380      1.00000
      2      -7.1428      1.00000
      3      -5.0574      1.00000
      4      -2.2387      1.00000
      5       0.9656      1.00000
      6       3.4709     -0.00000
      7       4.6610     -0.00000
      8       5.1687     -0.00000
      9       6.6602     -0.00000
     10       7.0505     -0.00000
     11       7.7440     -0.00000
     12       8.7206      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6655     -0.00000
     10       7.0821     -0.00000
     11       7.4698     -0.00000
     12       8.4022      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6655     -0.00000
     10       7.0821     -0.00000
     11       7.4698     -0.00000
     12       8.4022      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6655     -0.00000
     10       7.0821     -0.00000
     11       7.4698     -0.00000
     12       8.4022      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6655     -0.00000
     10       7.0821     -0.00000
     11       7.4698     -0.00000
     12       8.4022      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6655     -0.00000
     10       7.0821     -0.00000
     11       7.4698     -0.00000
     12       8.4022      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4584      1.00000
      2      -6.1603      1.00000
      3      -4.0736      1.00000
      4      -1.2807      1.00000
      5       1.3314      1.00000
      6       2.1834      1.00347
      7       3.0533     -0.00553
      8       4.9103     -0.00000
      9       5.6655     -0.00000
     10       7.0821     -0.00000
     11       7.4698     -0.00000
     12       8.4022      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2550      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2551      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2550      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2550      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2550      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3258      1.00000
      2      -5.0260      1.00000
      3      -2.9480      1.00000
      4      -0.5435      1.00000
      5      -0.0159      1.00000
      6       1.2337      1.00000
      7       3.0533     -0.00541
      8       3.3234     -0.00001
      9       5.6603     -0.00000
     10       6.5000     -0.00000
     11       7.1535     -0.00000
     12       8.2550      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0403      1.00000
      2      -3.7441      1.00000
      3      -2.0341      1.00000
      4      -1.7451      1.00000
      5      -0.7039      1.00000
      6       1.1384      1.00000
      7       1.7404      1.00000
      8       4.1650     -0.00000
      9       4.3729     -0.00000
     10       6.5612     -0.00000
     11       7.0694     -0.00000
     12       7.8049     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6376      1.00000
      2      -3.5716      1.00000
      3      -2.3735      1.00000
      4      -2.3019      1.00000
      5      -0.5720      1.00000
      6       0.2890      1.00000
      7       2.5567      0.78360
      8       2.9134     -0.03140
      9       5.3731     -0.00000
     10       5.8851     -0.00000
     11       6.6886     -0.00000
     12       7.8444     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6376      1.00000
      2      -3.5716      1.00000
      3      -2.3735      1.00000
      4      -2.3019      1.00000
      5      -0.5720      1.00000
      6       0.2890      1.00000
      7       2.5567      0.78360
      8       2.9134     -0.03140
      9       5.3731     -0.00000
     10       5.8851     -0.00000
     11       6.6886     -0.00000
     12       7.8444     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6376      1.00000
      2      -3.5716      1.00000
      3      -2.3735      1.00000
      4      -2.3019      1.00000
      5      -0.5720      1.00000
      6       0.2890      1.00000
      7       2.5567      0.78360
      8       2.9134     -0.03140
      9       5.3731     -0.00000
     10       5.8851     -0.00000
     11       6.6886     -0.00000
     12       7.8444     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -8.0485      1.00000
      3      -5.9672      1.00000
      4      -3.1488      1.00000
      5       0.1122      1.00000
      6       3.8853     -0.00000
      7       6.0400     -0.00000
      8       6.9798     -0.00000
      9       7.0159     -0.00000
     10       8.0031     -0.00000
     11       8.0904     -0.00000
     12       8.6003      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -8.0485      1.00000
      3      -5.9672      1.00000
      4      -3.1488      1.00000
      5       0.1122      1.00000
      6       3.8853     -0.00000
      7       6.0400     -0.00000
      8       6.9798     -0.00000
      9       7.0159     -0.00000
     10       8.0031     -0.00000
     11       8.0904     -0.00000
     12       8.6003      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -8.0485      1.00000
      3      -5.9672      1.00000
      4      -3.1488      1.00000
      5       0.1122      1.00000
      6       3.8853     -0.00000
      7       6.0400     -0.00000
      8       6.9798     -0.00000
      9       7.0159     -0.00000
     10       8.0031     -0.00000
     11       8.0904     -0.00000
     12       8.6003      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5885      1.00000
      2      -7.2939      1.00000
      3      -5.2090      1.00000
      4      -2.3886      1.00000
      5       0.8374      1.00000
      6       4.2519     -0.00000
      7       5.0962     -0.00000
      8       6.0389     -0.00000
      9       6.3524     -0.00000
     10       7.0359     -0.00000
     11       7.3183     -0.00000
     12       8.0614     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6846      1.00000
      2      -6.3873      1.00000
      3      -4.3001      1.00000
      4      -1.4919      1.00000
      5       1.6064      1.00000
      6       2.9206     -0.02991
      7       4.1552     -0.00000
      8       5.1907     -0.00000
      9       5.9619     -0.00000
     10       6.0571     -0.00000
     11       7.0279     -0.00000
     12       7.7182     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6279      1.00000
      2      -5.3285      1.00000
      3      -3.2450      1.00000
      4      -0.5163      1.00000
      5       0.8868      1.00000
      6       2.2136      1.00611
      7       2.9910     -0.01458
      8       4.2724     -0.00000
      9       5.0988     -0.00000
     10       6.2123     -0.00000
     11       6.6871     -0.00000
     12       7.3573     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63268
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63268
      8       3.9326     -0.00000
      9       4.7609     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63269
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63268
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63269
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4180      1.00000
      2      -4.1196      1.00000
      3      -2.0634      1.00000
      4      -0.9388      1.00000
      5       0.1575      1.00000
      6       1.1615      1.00000
      7       2.5988      0.63268
      8       3.9326     -0.00000
      9       4.7610     -0.00000
     10       5.4303     -0.00000
     11       6.4046     -0.00000
     12       7.6684     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0569      1.00000
      2      -2.7715      1.00000
      3      -2.5500      1.00000
      4      -1.3841      1.00000
      5      -0.6321      1.00000
      6       0.9696      1.00000
      7       2.2906      1.01874
      8       3.6070     -0.00000
      9       4.7151     -0.00000
     10       5.4562     -0.00000
     11       6.1851     -0.00000
     12       6.8199     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7600      1.00000
      2      -6.4629      1.00000
      3      -4.3757      1.00000
      4      -1.5638      1.00000
      5       1.5900      1.00000
      6       4.0026     -0.00000
      7       4.2200     -0.00000
      8       5.2316     -0.00000
      9       5.4339     -0.00000
     10       5.9979     -0.00000
     11       7.1118     -0.00000
     12       7.4399     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7600      1.00000
      2      -6.4629      1.00000
      3      -4.3757      1.00000
      4      -1.5638      1.00000
      5       1.5900      1.00000
      6       4.0026     -0.00000
      7       4.2200     -0.00000
      8       5.2316     -0.00000
      9       5.4339     -0.00000
     10       5.9979     -0.00000
     11       7.1118     -0.00000
     12       7.4399     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7600      1.00000
      2      -6.4629      1.00000
      3      -4.3757      1.00000
      4      -1.5638      1.00000
      5       1.5900      1.00000
      6       4.0026     -0.00000
      7       4.2200     -0.00000
      8       5.2316     -0.00000
      9       5.4339     -0.00000
     10       5.9979     -0.00000
     11       7.1118     -0.00000
     12       7.4399     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09073
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09072
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09073
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09072
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09073
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7789      1.00000
      2      -5.4798      1.00000
      3      -3.3944      1.00000
      4      -0.6222      1.00000
      5       1.9535      1.00001
      6       2.7460      0.09072
      7       3.6452     -0.00000
      8       3.7888     -0.00000
      9       4.8466     -0.00000
     10       5.5717     -0.00000
     11       6.5606     -0.00000
     12       7.0392     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6446      1.00000
      2      -4.3457      1.00000
      3      -2.2749      1.00000
      4       0.1083      1.00000
      5       0.6295      1.00000
      6       1.8557      1.00000
      7       3.1214     -0.00142
      8       3.6660     -0.00000
      9       4.0497     -0.00000
     10       4.7671     -0.00000
     11       6.3895     -0.00000
     12       6.9258     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3580      1.00000
      2      -3.0663      1.00000
      3      -1.3584      1.00000
      4      -1.0846      1.00000
      5      -0.0429      1.00000
      6       1.7409      1.00000
      7       2.2478      1.01037
      8       3.0560     -0.00519
      9       4.2856     -0.00000
     10       5.0895     -0.00000
     11       5.3100     -0.00000
     12       6.5513     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9596      1.00000
      2      -2.8868      1.00000
      3      -1.6932      1.00000
      4      -1.6411      1.00000
      5       0.0696      1.00000
      6       0.9449      1.00000
      7       2.7152      0.17965
      8       2.9329     -0.02696
      9       3.8763     -0.00000
     10       4.7360     -0.00000
     11       6.1553     -0.00000
     12       6.5065     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9596      1.00000
      2      -2.8868      1.00000
      3      -1.6932      1.00000
      4      -1.6411      1.00000
      5       0.0696      1.00000
      6       0.9449      1.00000
      7       2.7152      0.17966
      8       2.9329     -0.02696
      9       3.8763     -0.00000
     10       4.7360     -0.00000
     11       6.1553     -0.00000
     12       6.5065     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9596      1.00000
      2      -2.8868      1.00000
      3      -1.6932      1.00000
      4      -1.6411      1.00000
      5       0.0696      1.00000
      6       0.9449      1.00000
      7       2.7152      0.17966
      8       2.9329     -0.02696
      9       3.8763     -0.00000
     10       4.7360     -0.00000
     11       6.1553     -0.00000
     12       6.5065     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7201      1.00000
      2      -4.4211      1.00000
      3      -2.3469      1.00000
      4       0.2998      1.00000
      5       1.5952      1.00000
      6       1.9067      1.00000
      7       2.9599     -0.02091
      8       3.2306     -0.00009
      9       4.0119     -0.00000
     10       4.8202     -0.00000
     11       5.6496     -0.00000
     12       7.2626     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7201      1.00000
      2      -4.4211      1.00000
      3      -2.3469      1.00000
      4       0.2998      1.00000
      5       1.5952      1.00000
      6       1.9067      1.00000
      7       2.9599     -0.02091
      8       3.2306     -0.00009
      9       4.0119     -0.00000
     10       4.8202     -0.00000
     11       5.6496     -0.00000
     12       7.2626     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7201      1.00000
      2      -4.4211      1.00000
      3      -2.3469      1.00000
      4       0.2998      1.00000
      5       1.5952      1.00000
      6       1.9067      1.00000
      7       2.9599     -0.02091
      8       3.2306     -0.00009
      9       4.0119     -0.00000
     10       4.8202     -0.00000
     11       5.6496     -0.00000
     12       7.2626     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05092
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05092
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05092
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05092
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05092
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5088      1.00000
      2      -3.2150      1.00000
      3      -1.1818      1.00000
      4      -0.0482      1.00000
      5       0.9646      1.00000
      6       1.3619      1.00000
      7       2.0225      1.00008
      8       2.7643      0.05092
      9       3.6853     -0.00000
     10       4.9214     -0.00000
     11       5.1127     -0.00000
     12       6.3166     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1486      1.00000
      2      -1.8749      1.00000
      3      -1.6459      1.00000
      4      -0.5080      1.00000
      5       0.2220      1.00000
      6       1.2605      1.00000
      7       1.7740      1.00000
      8       2.3090      1.02270
      9       3.6776     -0.00000
     10       4.6299     -0.00000
     11       5.1626     -0.00000
     12       6.1546     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2231      1.00000
      2      -1.9451      1.00000
      3      -0.2833      1.00000
      4      -0.2031      1.00000
      5      -0.0546      1.00000
      6       0.8644      1.00000
      7       1.2167      1.00000
      8       2.4944      0.95212
      9       3.6862     -0.00000
     10       3.8445     -0.00000
     11       5.9783     -0.00000
     12       6.2079     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2231      1.00000
      2      -1.9451      1.00000
      3      -0.2833      1.00000
      4      -0.2031      1.00000
      5      -0.0546      1.00000
      6       0.8644      1.00000
      7       1.2167      1.00000
      8       2.4944      0.95212
      9       3.6862     -0.00000
     10       3.8445     -0.00000
     11       5.9783     -0.00000
     12       6.2083     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2231      1.00000
      2      -1.9451      1.00000
      3      -0.2833      1.00000
      4      -0.2031      1.00000
      5      -0.0546      1.00000
      6       0.8644      1.00000
      7       1.2167      1.00000
      8       2.4944      0.95212
      9       3.6862     -0.00000
     10       3.8445     -0.00000
     11       5.9784     -0.00000
     12       6.2063     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8362      1.00000
      2      -1.7530      1.00000
      3      -0.5765      1.00000
      4      -0.5593      1.00000
      5      -0.3062      1.00000
      6       0.6735      1.00000
      7       1.4279      1.00000
      8       1.8071      1.00000
      9       3.4851     -0.00000
     10       4.5840     -0.00000
     11       4.8565     -0.00000
     12       6.0311     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8362      1.00000
      2      -1.7530      1.00000
      3      -0.5765      1.00000
      4      -0.5593      1.00000
      5      -0.3062      1.00000
      6       0.6735      1.00000
      7       1.4279      1.00000
      8       1.8071      1.00000
      9       3.4851     -0.00000
     10       4.5840     -0.00000
     11       4.8565     -0.00000
     12       6.0311     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8362      1.00000
      2      -1.7530      1.00000
      3      -0.5765      1.00000
      4      -0.5593      1.00000
      5      -0.3062      1.00000
      6       0.6735      1.00000
      7       1.4279      1.00000
      8       1.8071      1.00000
      9       3.4851     -0.00000
     10       4.5840     -0.00000
     11       4.8565     -0.00000
     12       6.0311     -0.00000


--------------------------------------------------------------------------------------------------------


 soft charge-density along one line, spin component           1
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 soft charge-density along one line, spin component           2
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 pseudopotential strength for first ion, spin component:           1
  8.085  13.803  -0.000  -0.002  -0.000  -0.000  -0.006  -0.000
 13.803  23.557  -0.000  -0.003  -0.000  -0.000  -0.010  -0.000
 -0.000  -0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880  -0.000  -0.000   5.472  -0.000
 -0.000  -0.000   0.000  -0.000   1.879   0.000  -0.000   5.469
 -0.000  -0.000   5.469  -0.000   0.000  15.776  -0.000   0.000
 -0.006  -0.010  -0.000   5.472  -0.000  -0.000  15.784  -0.000
 -0.000  -0.000   0.000  -0.000   5.469   0.000  -0.000  15.776
 pseudopotential strength for first ion, spin component:           2
  8.085  13.803  -0.000  -0.002   0.000  -0.000  -0.006   0.000
 13.803  23.557  -0.000  -0.003   0.000  -0.000  -0.010   0.000
 -0.000  -0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880  -0.000  -0.000   5.472  -0.000
  0.000   0.000   0.000  -0.000   1.879   0.000  -0.000   5.469
 -0.000  -0.000   5.469  -0.000   0.000  15.776  -0.000   0.000
 -0.006  -0.010  -0.000   5.472  -0.000  -0.000  15.784  -0.000
  0.000   0.000   0.000  -0.000   5.469   0.000  -0.000  15.776
 total augmentation occupancy for first ion, spin component:           1
116.700 -62.320   0.000  -0.143   0.000  -0.000  -0.013  -0.000
-62.320  33.281  -0.000   0.065  -0.000   0.000   0.009   0.000
  0.000  -0.000   2.103   0.000  -0.000  -0.326  -0.000   0.000
 -0.143   0.065   0.000   1.667  -0.000  -0.000  -0.256   0.000
  0.000  -0.000  -0.000  -0.000   2.103   0.000   0.000  -0.326
 -0.000   0.000  -0.326  -0.000   0.000   0.051   0.000  -0.000
 -0.013   0.009  -0.000  -0.256   0.000   0.000   0.039  -0.000
 -0.000   0.000   0.000   0.000  -0.326  -0.000  -0.000   0.051
 total augmentation occupancy for first ion, spin component:           2
 -0.000   0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000
  0.000  -0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000
  0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000
  0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000  -0.000
  0.000  -0.000   0.000   0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000  -0.000  -0.000   0.000   0.000   0.000   0.000


------------------------ aborting loop because EDIFF is reached ----------------------------------------


    FORLOC:  cpu time      0.0009: real time      0.0009
    FORHF :  cpu time   1052.7954: real time   1056.9276
    FORNL :  cpu time      0.2686: real time      0.2701
    FORCOR:  cpu time      1.1776: real time      1.1810
    OFIELD:  cpu time      0.0001: real time      0.0001

 VOLUME and BASIS-vectors are now :
 -----------------------------------------------------------------------------
  energy-cutoff  :      400.00
  volume of cell :      120.20
      direct lattice vectors                 reciprocal lattice vectors
     2.857459769  0.000000000  0.000000000     0.349961183 -0.202050183  0.000000000
     1.428729885  2.474632750  0.000000000     0.000000000  0.404100366  0.000000000
     0.000000000  0.000000000 16.999318395     0.000000000  0.000000000  0.058825888

  length of vectors
     2.857459769  2.857459769 16.999318395     0.404100366  0.404100366  0.058825888


 FORCES acting on ions:
    Electron-Ion                     Ewald-Force                    Non-Local-Force
 -----------------------------------------------------------------------------------------------
   -.313E-06 0.136E-05 0.156E+03   0.410E-13 0.244E-13 -.155E+03   0.334E-06 -.139E-05 -.113E+01
   -.184E-05 -.628E-06 0.519E+02   -.130E-12 -.787E-13 -.519E+02   0.195E-05 0.583E-06 0.226E+00
   0.674E-06 -.178E-05 -.519E+02   0.130E-12 0.811E-13 0.519E+02   -.750E-06 0.165E-05 -.226E+00
   0.196E-05 0.445E-06 -.156E+03   -.406E-13 -.220E-13 0.155E+03   -.255E-05 0.954E-07 0.113E+01
 -----------------------------------------------------------------------------------------------
   -.371E-06 -.116E-05 0.363E-04   0.721E-15 0.484E-14 -.284E-13   -.102E-05 0.941E-06 -.205E-04
 
 
 POSITION                                       TOTAL-FORCE (eV/Angst)
 -----------------------------------------------------------------------------------
      0.00000      0.00000      0.00000         0.000000     -0.000000     -0.116224
      1.42873      0.82488      2.33311         0.000000     -0.000000      0.195187
      2.85746      1.64976      4.66621         0.000000     -0.000000     -0.195339
      0.00000      0.00000      6.99932        -0.000001      0.000000      0.116376
 -----------------------------------------------------------------------------------
    total drift:                               -0.000001     -0.000000      0.000016


--------------------------------------------------------------------------------------------------------



  FREE ENERGIE OF THE ION-ELECTRON SYSTEM (eV)
  ---------------------------------------------------
  free  energy   TOTEN  =       -10.94589956 eV

  energy  without entropy=      -10.94573186  energy(sigma->0) =      -10.94584366
 


--------------------------------------------------------------------------------------------------------


    POTLOK:  cpu time      1.1758: real time      1.1793


--------------------------------------------------------------------------------------------------------


 Quasi-Newton relaxation of ions (Broydens 2nd method)
  g(Force)  = 0.249E-02   g(Stress)= 0.000E+00

 Reset! Starting new Quasi-Newton update for ions 


--------------------------------------------------------------------------------------------------------


    WAVPRE:  cpu time      0.6040: real time      0.7469
    FEWALD:  cpu time      0.0002: real time      0.0002
    ORTHCH:  cpu time      0.0927: real time      0.0930
    POTLOK:  cpu time      1.1779: real time      1.1813
    EDDIAG:  cpu time   1297.4269: real time   1302.7558
    CHARGE:  cpu time      0.2435: real time      0.2445
 writing wavefunctions
     LOOP+:  cpu time  35313.3389: real time  35458.0939


--------------------------------------- Iteration      2(   1)  ---------------------------------------


    POTLOK:  cpu time      0.3887: real time      0.3901
    SETDIJ:  cpu time      0.7906: real time      0.7925
    TRIAL :  cpu time   1292.7515: real time   1298.0409
    CORREC:  cpu time      0.0065: real time      0.0065
    CHARGE:  cpu time      0.2420: real time      0.2430
    --------------------------------------------
      LOOP:  cpu time   1294.1884: real time   1299.4823

 eigenvalue-minimisations  :     0
 total energy-change (2. order) : 0.9279538E-03  (-0.1818217E-02)
 number of electron      12.0000000 magnetization      -0.0000020
 augmentation part       -0.0018459 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.89919145
  -exchange      EXHF   =        26.48908603
  -V(xc)+E(xc)   XCENC  =       -66.89056552
  PAW double counting   =     82001.42006066   -81920.65667574
  entropy T*S    EENTRO =         0.00004268
  eigenvalues    EBANDS =       -34.54146853
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94496284 eV

  energy without entropy =      -10.94500552  energy(sigma->0) =      -10.94497707
  exchange ACFDT corr.  =        -0.00066608  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      2(   2)  ---------------------------------------


    POTLOK:  cpu time      0.3828: real time      0.3842
    SETDIJ:  cpu time      0.7904: real time      0.7924
    TRIAL :  cpu time   1291.1003: real time   1296.3885
    CORREC:  cpu time      0.0060: real time      0.0060
    CHARGE:  cpu time      0.2416: real time      0.2426
    --------------------------------------------
      LOOP:  cpu time   1292.5215: real time   1297.8141

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1421810E-02  (-0.1286262E-02)
 number of electron      12.0000000 magnetization      -0.0000019
 augmentation part       -0.0018371 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.66977316
  -exchange      EXHF   =        26.48663331
  -V(xc)+E(xc)   XCENC  =       -66.89150019
  PAW double counting   =     82000.48433979   -81919.72083149
  entropy T*S    EENTRO =         0.00007306
  eigenvalues    EBANDS =       -34.76907674
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94638465 eV

  energy without entropy =      -10.94645771  energy(sigma->0) =      -10.94640901
  exchange ACFDT corr.  =        -0.00064815  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      2(   3)  ---------------------------------------


    POTLOK:  cpu time      0.3861: real time      0.3875
    SETDIJ:  cpu time      0.7893: real time      0.7914
    TRIAL :  cpu time   1287.6671: real time   1292.9654
    CORREC:  cpu time      0.0065: real time      0.0066
    CHARGE:  cpu time      0.2428: real time      0.2438
    --------------------------------------------
      LOOP:  cpu time   1289.0922: real time   1294.3950

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.8749784E-03  (-0.4687968E-03)
 number of electron      12.0000000 magnetization      -0.0000018
 augmentation part       -0.0018389 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.46766036
  -exchange      EXHF   =        26.48439889
  -V(xc)+E(xc)   XCENC  =       -66.89238099
  PAW double counting   =     82001.31361250   -81920.55002183
  entropy T*S    EENTRO =         0.00008456
  eigenvalues    EBANDS =       -34.96906205
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94725963 eV

  energy without entropy =      -10.94734419  energy(sigma->0) =      -10.94728782
  exchange ACFDT corr.  =        -0.00063904  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      2(   4)  ---------------------------------------


    POTLOK:  cpu time      0.3857: real time      0.3871
    SETDIJ:  cpu time      0.7900: real time      0.7921
    TRIAL :  cpu time   1291.3534: real time   1296.6541
    CORREC:  cpu time      0.0066: real time      0.0066
    CHARGE:  cpu time      0.2411: real time      0.2421
    --------------------------------------------
      LOOP:  cpu time   1292.7771: real time   1298.0823

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.2868196E-03  (-0.2208259E-03)
 number of electron      12.0000000 magnetization      -0.0000017
 augmentation part       -0.0018468 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.40660092
  -exchange      EXHF   =        26.48376533
  -V(xc)+E(xc)   XCENC  =       -66.89270144
  PAW double counting   =     82000.83970340   -81920.07618212
  entropy T*S    EENTRO =         0.00007834
  eigenvalues    EBANDS =       -35.02939642
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94754645 eV

  energy without entropy =      -10.94762479  energy(sigma->0) =      -10.94757257
  exchange ACFDT corr.  =        -0.00063478  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      2(   5)  ---------------------------------------


    POTLOK:  cpu time      0.3856: real time      0.3871
    SETDIJ:  cpu time      0.7905: real time      0.7925
    TRIAL :  cpu time   1290.8154: real time   1296.0666
    CORREC:  cpu time      0.0065: real time      0.0066
    CHARGE:  cpu time      0.2418: real time      0.2428
    --------------------------------------------
      LOOP:  cpu time   1292.2402: real time   1297.4959

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1634636E-03  (-0.1637961E-03)
 number of electron      12.0000000 magnetization      -0.0000016
 augmentation part       -0.0018551 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.44184149
  -exchange      EXHF   =        26.48433197
  -V(xc)+E(xc)   XCENC  =       -66.89257726
  PAW double counting   =     81999.83031251   -81919.06689849
  entropy T*S    EENTRO =         0.00006354
  eigenvalues    EBANDS =       -34.99489663
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94770992 eV

  energy without entropy =      -10.94777345  energy(sigma->0) =      -10.94773109
  exchange ACFDT corr.  =        -0.00063786  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      2(   6)  ---------------------------------------


    POTLOK:  cpu time      0.3858: real time      0.3872
    SETDIJ:  cpu time      0.7891: real time      0.7911
    TRIAL :  cpu time   1287.1178: real time   1292.3307
    CORREC:  cpu time      0.0065: real time      0.0065
    CHARGE:  cpu time      0.2428: real time      0.2438
    --------------------------------------------
      LOOP:  cpu time   1288.5422: real time   1293.7596

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1218541E-03  (-0.9003005E-04)
 number of electron      12.0000000 magnetization      -0.0000015
 augmentation part       -0.0018613 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.49618754
  -exchange      EXHF   =        26.48522787
  -V(xc)+E(xc)   XCENC  =       -66.89230679
  PAW double counting   =     81999.36378587   -81918.60048644
  entropy T*S    EENTRO =         0.00004836
  eigenvalues    EBANDS =       -34.94170943
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94783177 eV

  energy without entropy =      -10.94788013  energy(sigma->0) =      -10.94784789
  exchange ACFDT corr.  =        -0.00064501  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      2(   7)  ---------------------------------------


    POTLOK:  cpu time      0.3857: real time      0.3871
    SETDIJ:  cpu time      0.7918: real time      0.7939
    TRIAL :  cpu time   1290.4972: real time   1295.8209
    CORREC:  cpu time      0.0067: real time      0.0068
    CHARGE:  cpu time      0.2433: real time      0.2443
    --------------------------------------------
      LOOP:  cpu time   1291.9253: real time   1297.2536

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.6505359E-04  (-0.4312288E-04)
 number of electron      12.0000000 magnetization      -0.0000014
 augmentation part       -0.0018642 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.53089877
  -exchange      EXHF   =        26.48591809
  -V(xc)+E(xc)   XCENC  =       -66.89208468
  PAW double counting   =     81999.80785362   -81919.04460234
  entropy T*S    EENTRO =         0.00003689
  eigenvalues    EBANDS =       -34.90791225
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94789682 eV

  energy without entropy =      -10.94793371  energy(sigma->0) =      -10.94790912
  exchange ACFDT corr.  =        -0.00065221  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      2(   8)  ---------------------------------------


    POTLOK:  cpu time      0.3857: real time      0.3870
    SETDIJ:  cpu time      0.7913: real time      0.7934
    TRIAL :  cpu time   1292.2020: real time   1297.4810
    CORREC:  cpu time      0.0071: real time      0.0071
    CHARGE:  cpu time      0.2427: real time      0.2437
    --------------------------------------------
      LOOP:  cpu time   1293.6294: real time   1298.9128

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.3103477E-04  (-0.2527239E-04)
 number of electron      12.0000000 magnetization      -0.0000013
 augmentation part       -0.0018633 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.54440219
  -exchange      EXHF   =        26.48626584
  -V(xc)+E(xc)   XCENC  =       -66.89197243
  PAW double counting   =     82002.24476006   -81921.48152887
  entropy T*S    EENTRO =         0.00002988
  eigenvalues    EBANDS =       -34.89486830
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94792786 eV

  energy without entropy =      -10.94795774  energy(sigma->0) =      -10.94793782
  exchange ACFDT corr.  =        -0.00065748  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      2(   9)  ---------------------------------------


    POTLOK:  cpu time      0.3855: real time      0.3869
    SETDIJ:  cpu time      0.7897: real time      0.7918
    TRIAL :  cpu time   1293.8514: real time   1299.1259
    CORREC:  cpu time      0.0065: real time      0.0065
    CHARGE:  cpu time      0.2422: real time      0.2431
    --------------------------------------------
      LOOP:  cpu time   1295.2757: real time   1300.5548

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.2014694E-04  (-0.1802655E-04)
 number of electron      12.0000000 magnetization      -0.0000012
 augmentation part       -0.0018594 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.54614367
  -exchange      EXHF   =        26.48631332
  -V(xc)+E(xc)   XCENC  =       -66.89195902
  PAW double counting   =     82007.11384059   -81926.35058632
  entropy T*S    EENTRO =         0.00002633
  eigenvalues    EBANDS =       -34.89322393
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94794800 eV

  energy without entropy =      -10.94797433  energy(sigma->0) =      -10.94795678
  exchange ACFDT corr.  =        -0.00066072  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      2(  10)  ---------------------------------------


    POTLOK:  cpu time      0.3861: real time      0.3875
    SETDIJ:  cpu time      0.7897: real time      0.7917
    TRIAL :  cpu time   1289.1057: real time   1294.2717
    CORREC:  cpu time      0.0064: real time      0.0064
    CHARGE:  cpu time      0.2425: real time      0.2436
    --------------------------------------------
      LOOP:  cpu time   1290.5309: real time   1295.7013

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1434043E-04  (-0.1101292E-04)
 number of electron      12.0000000 magnetization      -0.0000012
 augmentation part       -0.0018543 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.54295901
  -exchange      EXHF   =        26.48618839
  -V(xc)+E(xc)   XCENC  =       -66.89200374
  PAW double counting   =     82014.19711467   -81933.43384143
  entropy T*S    EENTRO =         0.00002473
  eigenvalues    EBANDS =       -34.89626871
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94796235 eV

  energy without entropy =      -10.94798707  energy(sigma->0) =      -10.94797059
  exchange ACFDT corr.  =        -0.00066232  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      2(  11)  ---------------------------------------


    POTLOK:  cpu time      0.3856: real time      0.3869
    SETDIJ:  cpu time      0.7896: real time      0.7917
    TRIAL :  cpu time   1291.1500: real time   1296.3700
    CORREC:  cpu time      0.0071: real time      0.0071
    EDDIAG:  cpu time   1293.7285: real time   1299.2798
    CHARGE:  cpu time      0.2418: real time      0.2429
    --------------------------------------------
      LOOP:  cpu time   2586.3030: real time   2597.0788

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.8557123E-05  (-0.5778230E-05)
 number of electron      12.0000000 magnetization      -0.0000011
 augmentation part       -0.0018499 magnetization      -0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       277.22434799
  -Hartree energ DENC   =      -508.53760755
  -exchange      EXHF   =        26.48595046
  -V(xc)+E(xc)   XCENC  =       -66.89205852
  PAW double counting   =     82022.55981970   -81941.79653727
  entropy T*S    EENTRO =         0.00002380
  eigenvalues    EBANDS =       -34.90142767
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94797090 eV

  energy without entropy =      -10.94799470  energy(sigma->0) =      -10.94797883
  exchange ACFDT corr.  =        -0.00066309  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------


  average scaling for gradient   1.0798


 average (electrostatic) potential at core
  the test charge radii are     1.0406
  (the norm of the test charge is              1.0000)
       1 -70.4364       2 -70.3984       3 -70.4022       4 -70.4407
 
 
 
 E-fermi :   2.6320     XC(G=0):  -4.7769     alpha+bet : -8.1680

 Fermi energy:         2.6319604273

 spin component 1

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3659      1.00000
      2     -10.0563      1.00000
      3      -8.0209      1.00000
      4      -5.2254      1.00000
      5      -1.9161      1.00000
      6       2.0367      1.00010
      7       4.5269     -0.00000
      8       6.5230     -0.00000
      9       6.7273     -0.00000
     10      10.8452      0.00000
     11      10.8687      0.00000
     12      15.5444      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2909      1.00000
      2      -9.9810      1.00000
      3      -7.9451      1.00000
      4      -5.1480      1.00000
      5      -1.8400      1.00000
      6       2.1124      1.00073
      7       4.5912     -0.00000
      8       6.5858     -0.00000
      9       6.7886     -0.00000
     10      10.8928      0.00000
     11      10.9241      0.00000
     12      13.9352      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2909      1.00000
      2      -9.9810      1.00000
      3      -7.9451      1.00000
      4      -5.1480      1.00000
      5      -1.8400      1.00000
      6       2.1124      1.00073
      7       4.5912     -0.00000
      8       6.5858     -0.00000
      9       6.7886     -0.00000
     10      10.8928      0.00000
     11      10.9241      0.00000
     12      13.9352      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2909      1.00000
      2      -9.9810      1.00000
      3      -7.9451      1.00000
      4      -5.1480      1.00000
      5      -1.8400      1.00000
      6       2.1124      1.00073
      7       4.5912     -0.00000
      8       6.5858     -0.00000
      9       6.7886     -0.00000
     10      10.8928      0.00000
     11      10.9241      0.00000
     12      13.9352      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0659      1.00000
      2      -9.7553      1.00000
      3      -7.7178      1.00000
      4      -4.9160      1.00000
      5      -1.6121      1.00000
      6       2.3362      1.02840
      7       4.7827     -0.00000
      8       6.7723     -0.00000
      9       6.9700     -0.00000
     10      10.9788      0.00000
     11      11.0832      0.00000
     12      11.9667      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0659      1.00000
      2      -9.7553      1.00000
      3      -7.7178      1.00000
      4      -4.9160      1.00000
      5      -1.6121      1.00000
      6       2.3362      1.02840
      7       4.7827     -0.00000
      8       6.7723     -0.00000
      9       6.9700     -0.00000
     10      10.9788      0.00000
     11      11.0832      0.00000
     12      11.9667      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0659      1.00000
      2      -9.7553      1.00000
      3      -7.7178      1.00000
      4      -4.9160      1.00000
      5      -1.6121      1.00000
      6       2.3362      1.02840
      7       4.7827     -0.00000
      8       6.7723     -0.00000
      9       6.9700     -0.00000
     10      10.9788      0.00000
     11      11.0832      0.00000
     12      11.9667      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6908      1.00000
      2      -9.3790      1.00000
      3      -7.3390      1.00000
      4      -4.5301      1.00000
      5      -1.2335      1.00000
      6       2.6984      0.23790
      7       5.0970     -0.00000
      8       7.0728     -0.00000
      9       7.2580     -0.00000
     10       9.7627      0.00000
     11      10.6482      0.00000
     12      12.4949      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6908      1.00000
      2      -9.3790      1.00000
      3      -7.3390      1.00000
      4      -4.5301      1.00000
      5      -1.2335      1.00000
      6       2.6984      0.23790
      7       5.0970     -0.00000
      8       7.0728     -0.00000
      9       7.2581     -0.00000
     10       9.7627      0.00000
     11      10.6482      0.00000
     12      12.2213      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6908      1.00000
      2      -9.3790      1.00000
      3      -7.3390      1.00000
      4      -4.5301      1.00000
      5      -1.2335      1.00000
      6       2.6984      0.23790
      7       5.0970     -0.00000
      8       7.0728     -0.00000
      9       7.2580     -0.00000
     10       9.7627      0.00000
     11      10.6482      0.00000
     12      12.0745      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1654      1.00000
      2      -8.8519      1.00000
      3      -6.8086      1.00000
      4      -3.9914      1.00000
      5      -0.7066      1.00000
      6       3.1817     -0.00036
      7       5.5138     -0.00000
      8       7.2116     -0.00000
      9       7.5887     -0.00000
     10       8.1181      0.00000
     11       8.7167      0.00000
     12      10.4400      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1654      1.00000
      2      -8.8519      1.00000
      3      -6.8086      1.00000
      4      -3.9914      1.00000
      5      -0.7066      1.00000
      6       3.1817     -0.00036
      7       5.5138     -0.00000
      8       7.2116     -0.00000
      9       7.5887     -0.00000
     10       8.1181      0.00000
     11       8.7167      0.00000
     12      10.4400      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1654      1.00000
      2      -8.8519      1.00000
      3      -6.8086      1.00000
      4      -3.9914      1.00000
      5      -0.7066      1.00000
      6       3.1817     -0.00036
      7       5.5138     -0.00000
      8       7.2116     -0.00000
      9       7.5887     -0.00000
     10       8.1181      0.00000
     11       8.7167      0.00000
     12      10.4400      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4895      1.00000
      2      -8.1735      1.00000
      3      -6.1263      1.00000
      4      -3.3016      1.00000
      5      -0.0375      1.00000
      6       3.7225     -0.00000
      7       5.3962     -0.00000
      8       6.2663     -0.00000
      9       6.7011     -0.00000
     10       8.1036      0.00000
     11       8.2536      0.00000
     12       8.6248      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4895      1.00000
      2      -8.1735      1.00000
      3      -6.1263      1.00000
      4      -3.3016      1.00000
      5      -0.0375      1.00000
      6       3.7225     -0.00000
      7       5.3962     -0.00000
      8       6.2663     -0.00000
      9       6.7011     -0.00000
     10       8.1036      0.00000
     11       8.2535      0.00000
     12       8.6248      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4895      1.00000
      2      -8.1735      1.00000
      3      -6.1263      1.00000
      4      -3.3016      1.00000
      5      -0.0375      1.00000
      6       3.7225     -0.00000
      7       5.3962     -0.00000
      8       6.2663     -0.00000
      9       6.7011     -0.00000
     10       8.1036      0.00000
     11       8.2536      0.00000
     12       8.6248      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6624      1.00000
      2      -7.3434      1.00000
      3      -5.2922      1.00000
      4      -2.4657      1.00000
      5       0.7476      1.00000
      6       3.2585     -0.00004
      7       4.4852     -0.00000
      8       5.0146     -0.00000
      9       6.4794     -0.00000
     10       6.9560     -0.00000
     11       8.8142      0.00000
     12      10.6761      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6624      1.00000
      2      -7.3434      1.00000
      3      -5.2922      1.00000
      4      -2.4657      1.00000
      5       0.7476      1.00000
      6       3.2585     -0.00004
      7       4.4852     -0.00000
      8       5.0146     -0.00000
      9       6.4794     -0.00000
     10       6.9560     -0.00000
     11       8.8141      0.00000
     12      10.6564      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6624      1.00000
      2      -7.3434      1.00000
      3      -5.2922      1.00000
      4      -2.4657      1.00000
      5       0.7476      1.00000
      6       3.2585     -0.00004
      7       4.4852     -0.00000
      8       5.0146     -0.00000
      9       6.4794     -0.00000
     10       6.9560     -0.00000
     11       8.8142      0.00000
     12      10.6952      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6834      1.00000
      2      -6.3610      1.00000
      3      -4.3080      1.00000
      4      -1.5036      1.00000
      5       1.1150      1.00000
      6       1.9699      1.00001
      7       2.8683     -0.03507
      8       4.7125     -0.00000
      9       5.5672     -0.00000
     10       7.2785     -0.00000
     11       7.6869     -0.00000
     12      10.2808      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6834      1.00000
      2      -6.3610      1.00000
      3      -4.3080      1.00000
      4      -1.5036      1.00000
      5       1.1150      1.00000
      6       1.9699      1.00001
      7       2.8683     -0.03507
      8       4.7125     -0.00000
      9       5.5672     -0.00000
     10       7.2785     -0.00000
     11       7.6869     -0.00000
     12      10.2815      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6834      1.00000
      2      -6.3610      1.00000
      3      -4.3080      1.00000
      4      -1.5036      1.00000
      5       1.1150      1.00000
      6       1.9699      1.00001
      7       2.8683     -0.03507
      8       4.7125     -0.00000
      9       5.5672     -0.00000
     10       7.2785     -0.00000
     11       7.6869     -0.00000
     12      10.2816      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5515      1.00000
      2      -5.2265      1.00000
      3      -3.1808      1.00000
      4      -0.7618      1.00000
      5      -0.2336      1.00000
      6       1.0345      1.00000
      7       2.8555     -0.03335
      8       3.1117     -0.00181
      9       5.5780     -0.00000
     10       6.5509     -0.00000
     11       8.3102      0.00000
     12       9.9591      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5515      1.00000
      2      -5.2265      1.00000
      3      -3.1808      1.00000
      4      -0.7618      1.00000
      5      -0.2336      1.00000
      6       1.0345      1.00000
      7       2.8555     -0.03335
      8       3.1117     -0.00181
      9       5.5780     -0.00000
     10       6.5509     -0.00000
     11       8.3102      0.00000
     12       9.9581      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5515      1.00000
      2      -5.2265      1.00000
      3      -3.1808      1.00000
      4      -0.7618      1.00000
      5      -0.2336      1.00000
      6       1.0345      1.00000
      7       2.8555     -0.03335
      8       3.1117     -0.00181
      9       5.5780     -0.00000
     10       6.5509     -0.00000
     11       8.3102      0.00000
     12       9.9392      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2666      1.00000
      2      -3.9439      1.00000
      3      -2.2595      1.00000
      4      -1.9714      1.00000
      5      -0.9030      1.00000
      6       0.9173      1.00000
      7       1.5294      1.00000
      8       4.0083     -0.00000
      9       4.1864     -0.00000
     10       6.8808     -0.00000
     11       7.6027     -0.00000
     12       9.8035      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2666      1.00000
      2      -3.9439      1.00000
      3      -2.2595      1.00000
      4      -1.9714      1.00000
      5      -0.9030      1.00000
      6       0.9173      1.00000
      7       1.5294      1.00000
      8       4.0083     -0.00000
      9       4.1864     -0.00000
     10       6.8808     -0.00000
     11       7.6027     -0.00000
     12       9.8035      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2666      1.00000
      2      -3.9439      1.00000
      3      -2.2595      1.00000
      4      -1.9714      1.00000
      5      -0.9030      1.00000
      6       0.9173      1.00000
      7       1.5294      1.00000
      8       4.0083     -0.00000
      9       4.1864     -0.00000
     10       6.8808     -0.00000
     11       7.6027     -0.00000
     12       9.8035      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8599      1.00000
      2      -3.8023      1.00000
      3      -2.5734      1.00000
      4      -2.4978      1.00000
      5      -0.7944      1.00000
      6       0.0540      1.00000
      7       2.3613      1.03328
      8       2.7257      0.14857
      9       5.2664     -0.00000
     10       5.7038     -0.00000
     11       8.4707      0.00000
     12       9.4025      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8599      1.00000
      2      -3.8023      1.00000
      3      -2.5734      1.00000
      4      -2.4978      1.00000
      5      -0.7944      1.00000
      6       0.0540      1.00000
      7       2.3613      1.03328
      8       2.7257      0.14857
      9       5.2664     -0.00000
     10       5.7038     -0.00000
     11       8.4707      0.00000
     12       9.7063      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8599      1.00000
      2      -3.8023      1.00000
      3      -2.5734      1.00000
      4      -2.4978      1.00000
      5      -0.7944      1.00000
      6       0.0540      1.00000
      7       2.3613      1.03328
      8       2.7257      0.14857
      9       5.2664     -0.00000
     10       5.7038     -0.00000
     11       8.4707      0.00000
     12       9.7058      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1409      1.00000
      2      -9.8305      1.00000
      3      -7.7936      1.00000
      4      -4.9933      1.00000
      5      -1.6880      1.00000
      6       2.2621      1.01247
      7       4.7191     -0.00000
      8       6.7105     -0.00000
      9       6.9100     -0.00000
     10      10.9758      0.00000
     11      11.0284      0.00000
     12      12.9547      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1409      1.00000
      2      -9.8305      1.00000
      3      -7.7936      1.00000
      4      -4.9933      1.00000
      5      -1.6880      1.00000
      6       2.2621      1.01247
      7       4.7191     -0.00000
      8       6.7105     -0.00000
      9       6.9100     -0.00000
     10      10.9758      0.00000
     11      11.0284      0.00000
     12      12.9391      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1409      1.00000
      2      -9.8305      1.00000
      3      -7.7936      1.00000
      4      -4.9933      1.00000
      5      -1.6880      1.00000
      6       2.2621      1.01247
      7       4.7191     -0.00000
      8       6.7105     -0.00000
      9       6.9100     -0.00000
     10      10.9758      0.00000
     11      11.0284      0.00000
     12      12.9402      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80234
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1912      0.00000
     12      11.5474      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80234
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1912      0.00000
     12      11.5473      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80234
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1912      0.00000
     12      11.5474      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80234
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1912      0.00000
     12      11.5474      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80234
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1912      0.00000
     12      11.5473      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80234
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1912      0.00000
     12      11.5474      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0528      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0528      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0528      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0528      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0528      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0528      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
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      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5033      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
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      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5033      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
      7       5.7465     -0.00000
      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5033      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
      7       5.7465     -0.00000
      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5033      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
      7       5.7465     -0.00000
      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5033      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
      7       5.7465     -0.00000
      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5033      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4385      0.00000
     12       9.3385      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4385      0.00000
     12       9.3383      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4385      0.00000
     12       9.3384      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4385      0.00000
     12       9.3383      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4385      0.00000
     12       9.3385      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4385      0.00000
     12       9.3386      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95999
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95999
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95998
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95999
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95998
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95999
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63650
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63651
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63651
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63650
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63651
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63651
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4657      1.00000
      2      -9.1531      1.00000
      3      -7.1117      1.00000
      4      -4.2990      1.00000
      5      -1.0071      1.00000
      6       2.9103     -0.03219
      7       5.2830     -0.00000
      8       7.2512     -0.00000
      9       7.4219     -0.00000
     10       9.9201      0.00000
     11       9.9291      0.00000
     12      10.8208      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4657      1.00000
      2      -9.1531      1.00000
      3      -7.1117      1.00000
      4      -4.2990      1.00000
      5      -1.0071      1.00000
      6       2.9103     -0.03219
      7       5.2830     -0.00000
      8       7.2512     -0.00000
      9       7.4219     -0.00000
     10       9.9201      0.00000
     11       9.9291      0.00000
     12      10.8324      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4657      1.00000
      2      -9.1531      1.00000
      3      -7.1117      1.00000
      4      -4.2990      1.00000
      5      -1.0071      1.00000
      6       2.9103     -0.03219
      7       5.2830     -0.00000
      8       7.2512     -0.00000
      9       7.4219     -0.00000
     10       9.9201      0.00000
     11       9.9292      0.00000
     12      10.8480      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2137      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2137      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2137      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2137      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2137      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2137      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4675      0.00000
     12       8.7275      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4675      0.00000
     12       8.7275      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4675      0.00000
     12       8.7275      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4675      0.00000
     12       8.7275      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4675      0.00000
     12       8.7275      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4675      0.00000
     12       8.7275      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3866      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3866      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3866      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3866      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3866      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3866      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2732      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2732      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2732      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2732      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2732      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2732      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7498      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7497      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7498      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7498      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7498      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7497      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6336      1.00000
      2      -3.5736      1.00000
      3      -2.3456      1.00000
      4      -2.2770      1.00000
      5      -0.5781      1.00000
      6       0.2794      1.00000
      7       2.5577      0.79269
      8       2.9125     -0.03172
      9       5.3749     -0.00000
     10       5.8847     -0.00000
     11       6.6892     -0.00000
     12       7.8662     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6336      1.00000
      2      -3.5736      1.00000
      3      -2.3456      1.00000
      4      -2.2770      1.00000
      5      -0.5781      1.00000
      6       0.2794      1.00000
      7       2.5577      0.79269
      8       2.9125     -0.03172
      9       5.3749     -0.00000
     10       5.8847     -0.00000
     11       6.6892     -0.00000
     12       7.8662     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6336      1.00000
      2      -3.5736      1.00000
      3      -2.3456      1.00000
      4      -2.2770      1.00000
      5      -0.5781      1.00000
      6       0.2794      1.00000
      7       2.5577      0.79269
      8       2.9125     -0.03172
      9       5.3749     -0.00000
     10       5.8847     -0.00000
     11       6.6892     -0.00000
     12       7.8662     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3392      1.00000
      2      -8.0227      1.00000
      3      -5.9747      1.00000
      4      -3.1486      1.00000
      5       0.1128      1.00000
      6       3.8865     -0.00000
      7       6.0364     -0.00000
      8       6.9769     -0.00000
      9       7.0162     -0.00000
     10       8.0257     -0.00000
     11       8.1139      0.00000
     12       8.4783      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3392      1.00000
      2      -8.0227      1.00000
      3      -5.9747      1.00000
      4      -3.1486      1.00000
      5       0.1128      1.00000
      6       3.8865     -0.00000
      7       6.0364     -0.00000
      8       6.9769     -0.00000
      9       7.0162     -0.00000
     10       8.0257     -0.00000
     11       8.1139      0.00000
     12       8.4783      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3392      1.00000
      2      -8.0227      1.00000
      3      -5.9747      1.00000
      4      -3.1486      1.00000
      5       0.1128      1.00000
      6       3.8865     -0.00000
      7       6.0364     -0.00000
      8       6.9769     -0.00000
      9       7.0162     -0.00000
     10       8.0257     -0.00000
     11       8.1139      0.00000
     12       8.4783      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7586      1.00000
      2      -6.4368      1.00000
      3      -4.3833      1.00000
      4      -1.5636      1.00000
      5       1.5906      1.00000
      6       4.0003     -0.00000
      7       4.2235     -0.00000
      8       5.2499     -0.00000
      9       5.4582     -0.00000
     10       6.0078     -0.00000
     11       7.1063     -0.00000
     12       7.4291     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7586      1.00000
      2      -6.4368      1.00000
      3      -4.3833      1.00000
      4      -1.5636      1.00000
      5       1.5906      1.00000
      6       4.0003     -0.00000
      7       4.2235     -0.00000
      8       5.2499     -0.00000
      9       5.4582     -0.00000
     10       6.0078     -0.00000
     11       7.1063     -0.00000
     12       7.4291     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7586      1.00000
      2      -6.4368      1.00000
      3      -4.3833      1.00000
      4      -1.5636      1.00000
      5       1.5906      1.00000
      6       4.0003     -0.00000
      7       4.2235     -0.00000
      8       5.2499     -0.00000
      9       5.4582     -0.00000
     10       6.0078     -0.00000
     11       7.1063     -0.00000
     12       7.4291     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9556      1.00000
      2      -2.8888      1.00000
      3      -1.6651      1.00000
      4      -1.6160      1.00000
      5       0.0638      1.00000
      6       0.9357      1.00000
      7       2.7137      0.18572
      8       2.9404     -0.02584
      9       3.8785     -0.00000
     10       4.7523     -0.00000
     11       6.1573     -0.00000
     12       6.4957     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9556      1.00000
      2      -2.8888      1.00000
      3      -1.6651      1.00000
      4      -1.6159      1.00000
      5       0.0638      1.00000
      6       0.9357      1.00000
      7       2.7137      0.18572
      8       2.9404     -0.02584
      9       3.8785     -0.00000
     10       4.7523     -0.00000
     11       6.1573     -0.00000
     12       6.4957     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9556      1.00000
      2      -2.8888      1.00000
      3      -1.6651      1.00000
      4      -1.6160      1.00000
      5       0.0638      1.00000
      6       0.9357      1.00000
      7       2.7137      0.18572
      8       2.9404     -0.02584
      9       3.8785     -0.00000
     10       4.7523     -0.00000
     11       6.1573     -0.00000
     12       6.4957     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7189      1.00000
      2      -4.3946      1.00000
      3      -2.3543      1.00000
      4       0.3010      1.00000
      5       1.5988      1.00000
      6       1.9062      1.00000
      7       2.9800     -0.01697
      8       3.2547     -0.00005
      9       4.0160     -0.00000
     10       4.8143     -0.00000
     11       5.6401     -0.00000
     12       7.2654     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7189      1.00000
      2      -4.3946      1.00000
      3      -2.3543      1.00000
      4       0.3010      1.00000
      5       1.5988      1.00000
      6       1.9062      1.00000
      7       2.9800     -0.01697
      8       3.2547     -0.00005
      9       4.0160     -0.00000
     10       4.8143     -0.00000
     11       5.6401     -0.00000
     12       7.2654     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7189      1.00000
      2      -4.3946      1.00000
      3      -2.3543      1.00000
      4       0.3010      1.00000
      5       1.5988      1.00000
      6       1.9062      1.00000
      7       2.9800     -0.01697
      8       3.2547     -0.00005
      9       4.0160     -0.00000
     10       4.8143     -0.00000
     11       5.6401     -0.00000
     12       7.2654     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2220      1.00000
      2      -1.9183      1.00000
      3      -0.2785      1.00000
      4      -0.2055      1.00000
      5      -0.0580      1.00000
      6       0.8920      1.00000
      7       1.2357      1.00000
      8       2.4884      0.96608
      9       3.6860     -0.00000
     10       3.8352     -0.00000
     11       5.9778     -0.00000
     12       6.2088     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2220      1.00000
      2      -1.9183      1.00000
      3      -0.2785      1.00000
      4      -0.2055      1.00000
      5      -0.0580      1.00000
      6       0.8920      1.00000
      7       1.2357      1.00000
      8       2.4884      0.96608
      9       3.6860     -0.00000
     10       3.8352     -0.00000
     11       5.9777     -0.00000
     12       6.2115     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2220      1.00000
      2      -1.9183      1.00000
      3      -0.2785      1.00000
      4      -0.2055      1.00000
      5      -0.0580      1.00000
      6       0.8920      1.00000
      7       1.2357      1.00000
      8       2.4884      0.96608
      9       3.6860     -0.00000
     10       3.8352     -0.00000
     11       5.9781     -0.00000
     12       6.2073     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8321      1.00000
      2      -1.7552      1.00000
      3      -0.5495      1.00000
      4      -0.5342      1.00000
      5      -0.3044      1.00000
      6       0.6913      1.00000
      7       1.4298      1.00000
      8       1.7991      1.00000
      9       3.4758     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8321      1.00000
      2      -1.7552      1.00000
      3      -0.5495      1.00000
      4      -0.5342      1.00000
      5      -0.3044      1.00000
      6       0.6913      1.00000
      7       1.4298      1.00000
      8       1.7991      1.00000
      9       3.4758     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8321      1.00000
      2      -1.7552      1.00000
      3      -0.5495      1.00000
      4      -0.5342      1.00000
      5      -0.3044      1.00000
      6       0.6913      1.00000
      7       1.4298      1.00000
      8       1.7991      1.00000
      9       3.4758     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000
 Fermi energy:         2.6319604273

 spin component 2

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3659      1.00000
      2     -10.0563      1.00000
      3      -8.0209      1.00000
      4      -5.2254      1.00000
      5      -1.9161      1.00000
      6       2.0367      1.00010
      7       4.5269     -0.00000
      8       6.5230     -0.00000
      9       6.7273     -0.00000
     10      10.8452      0.00000
     11      10.8687      0.00000
     12      15.5424      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2909      1.00000
      2      -9.9810      1.00000
      3      -7.9451      1.00000
      4      -5.1480      1.00000
      5      -1.8400      1.00000
      6       2.1124      1.00072
      7       4.5912     -0.00000
      8       6.5858     -0.00000
      9       6.7886     -0.00000
     10      10.8928      0.00000
     11      10.9241      0.00000
     12      13.9352      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2909      1.00000
      2      -9.9810      1.00000
      3      -7.9451      1.00000
      4      -5.1480      1.00000
      5      -1.8400      1.00000
      6       2.1124      1.00072
      7       4.5912     -0.00000
      8       6.5858     -0.00000
      9       6.7886     -0.00000
     10      10.8928      0.00000
     11      10.9241      0.00000
     12      13.9352      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2909      1.00000
      2      -9.9810      1.00000
      3      -7.9451      1.00000
      4      -5.1480      1.00000
      5      -1.8400      1.00000
      6       2.1124      1.00072
      7       4.5912     -0.00000
      8       6.5858     -0.00000
      9       6.7886     -0.00000
     10      10.8928      0.00000
     11      10.9241      0.00000
     12      13.9352      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0659      1.00000
      2      -9.7553      1.00000
      3      -7.7178      1.00000
      4      -4.9160      1.00000
      5      -1.6121      1.00000
      6       2.3362      1.02840
      7       4.7827     -0.00000
      8       6.7723     -0.00000
      9       6.9700     -0.00000
     10      10.9788      0.00000
     11      11.0832      0.00000
     12      11.9667      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0659      1.00000
      2      -9.7553      1.00000
      3      -7.7178      1.00000
      4      -4.9160      1.00000
      5      -1.6121      1.00000
      6       2.3362      1.02840
      7       4.7827     -0.00000
      8       6.7723     -0.00000
      9       6.9700     -0.00000
     10      10.9788      0.00000
     11      11.0832      0.00000
     12      11.9667      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0659      1.00000
      2      -9.7553      1.00000
      3      -7.7178      1.00000
      4      -4.9160      1.00000
      5      -1.6121      1.00000
      6       2.3362      1.02840
      7       4.7827     -0.00000
      8       6.7723     -0.00000
      9       6.9700     -0.00000
     10      10.9788      0.00000
     11      11.0832      0.00000
     12      11.9667      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6908      1.00000
      2      -9.3790      1.00000
      3      -7.3390      1.00000
      4      -4.5301      1.00000
      5      -1.2335      1.00000
      6       2.6984      0.23791
      7       5.0970     -0.00000
      8       7.0728     -0.00000
      9       7.2580     -0.00000
     10       9.7627      0.00000
     11      10.6482      0.00000
     12      12.1165      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6908      1.00000
      2      -9.3790      1.00000
      3      -7.3390      1.00000
      4      -4.5301      1.00000
      5      -1.2335      1.00000
      6       2.6984      0.23791
      7       5.0970     -0.00000
      8       7.0728     -0.00000
      9       7.2580     -0.00000
     10       9.7627      0.00000
     11      10.6482      0.00000
     12      11.9443      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6908      1.00000
      2      -9.3790      1.00000
      3      -7.3390      1.00000
      4      -4.5301      1.00000
      5      -1.2335      1.00000
      6       2.6984      0.23791
      7       5.0970     -0.00000
      8       7.0728     -0.00000
      9       7.2580     -0.00000
     10       9.7627      0.00000
     11      10.6482      0.00000
     12      12.4423      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1654      1.00000
      2      -8.8519      1.00000
      3      -6.8086      1.00000
      4      -3.9914      1.00000
      5      -0.7066      1.00000
      6       3.1817     -0.00036
      7       5.5138     -0.00000
      8       7.2116     -0.00000
      9       7.5887     -0.00000
     10       8.1181      0.00000
     11       8.7167      0.00000
     12      10.4400      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1654      1.00000
      2      -8.8519      1.00000
      3      -6.8086      1.00000
      4      -3.9914      1.00000
      5      -0.7066      1.00000
      6       3.1817     -0.00036
      7       5.5138     -0.00000
      8       7.2116     -0.00000
      9       7.5887     -0.00000
     10       8.1181      0.00000
     11       8.7167      0.00000
     12      10.4400      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1654      1.00000
      2      -8.8519      1.00000
      3      -6.8086      1.00000
      4      -3.9914      1.00000
      5      -0.7066      1.00000
      6       3.1817     -0.00036
      7       5.5138     -0.00000
      8       7.2116     -0.00000
      9       7.5887     -0.00000
     10       8.1181      0.00000
     11       8.7167      0.00000
     12      10.4400      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4895      1.00000
      2      -8.1735      1.00000
      3      -6.1263      1.00000
      4      -3.3016      1.00000
      5      -0.0375      1.00000
      6       3.7225     -0.00000
      7       5.3962     -0.00000
      8       6.2663     -0.00000
      9       6.7011     -0.00000
     10       8.1036      0.00000
     11       8.2535      0.00000
     12       8.6248      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4895      1.00000
      2      -8.1735      1.00000
      3      -6.1263      1.00000
      4      -3.3016      1.00000
      5      -0.0375      1.00000
      6       3.7225     -0.00000
      7       5.3962     -0.00000
      8       6.2663     -0.00000
      9       6.7011     -0.00000
     10       8.1036      0.00000
     11       8.2535      0.00000
     12       8.6248      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4895      1.00000
      2      -8.1735      1.00000
      3      -6.1263      1.00000
      4      -3.3016      1.00000
      5      -0.0375      1.00000
      6       3.7225     -0.00000
      7       5.3962     -0.00000
      8       6.2663     -0.00000
      9       6.7011     -0.00000
     10       8.1036      0.00000
     11       8.2535      0.00000
     12       8.6248      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6624      1.00000
      2      -7.3434      1.00000
      3      -5.2922      1.00000
      4      -2.4657      1.00000
      5       0.7476      1.00000
      6       3.2585     -0.00004
      7       4.4852     -0.00000
      8       5.0146     -0.00000
      9       6.4794     -0.00000
     10       6.9560     -0.00000
     11       8.8124      0.00000
     12      10.1137      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6624      1.00000
      2      -7.3434      1.00000
      3      -5.2922      1.00000
      4      -2.4657      1.00000
      5       0.7476      1.00000
      6       3.2585     -0.00004
      7       4.4852     -0.00000
      8       5.0146     -0.00000
      9       6.4794     -0.00000
     10       6.9560     -0.00000
     11       8.8141      0.00000
     12      10.5396      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6624      1.00000
      2      -7.3434      1.00000
      3      -5.2922      1.00000
      4      -2.4657      1.00000
      5       0.7476      1.00000
      6       3.2585     -0.00004
      7       4.4852     -0.00000
      8       5.0146     -0.00000
      9       6.4794     -0.00000
     10       6.9560     -0.00000
     11       8.8134      0.00000
     12      10.3178      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6834      1.00000
      2      -6.3610      1.00000
      3      -4.3080      1.00000
      4      -1.5036      1.00000
      5       1.1150      1.00000
      6       1.9699      1.00001
      7       2.8683     -0.03507
      8       4.7125     -0.00000
      9       5.5672     -0.00000
     10       7.2785     -0.00000
     11       7.6869     -0.00000
     12      10.2794      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6834      1.00000
      2      -6.3610      1.00000
      3      -4.3080      1.00000
      4      -1.5036      1.00000
      5       1.1150      1.00000
      6       1.9699      1.00001
      7       2.8683     -0.03507
      8       4.7125     -0.00000
      9       5.5672     -0.00000
     10       7.2785     -0.00000
     11       7.6869     -0.00000
     12      10.2816      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6834      1.00000
      2      -6.3610      1.00000
      3      -4.3080      1.00000
      4      -1.5036      1.00000
      5       1.1150      1.00000
      6       1.9699      1.00001
      7       2.8683     -0.03507
      8       4.7125     -0.00000
      9       5.5672     -0.00000
     10       7.2785     -0.00000
     11       7.6869     -0.00000
     12      10.2816      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5515      1.00000
      2      -5.2265      1.00000
      3      -3.1808      1.00000
      4      -0.7618      1.00000
      5      -0.2336      1.00000
      6       1.0345      1.00000
      7       2.8555     -0.03335
      8       3.1117     -0.00181
      9       5.5780     -0.00000
     10       6.5509     -0.00000
     11       8.3102      0.00000
     12       9.8861      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5515      1.00000
      2      -5.2265      1.00000
      3      -3.1808      1.00000
      4      -0.7618      1.00000
      5      -0.2336      1.00000
      6       1.0345      1.00000
      7       2.8555     -0.03335
      8       3.1117     -0.00181
      9       5.5780     -0.00000
     10       6.5509     -0.00000
     11       8.3102      0.00000
     12       9.9270      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5515      1.00000
      2      -5.2265      1.00000
      3      -3.1808      1.00000
      4      -0.7618      1.00000
      5      -0.2336      1.00000
      6       1.0345      1.00000
      7       2.8555     -0.03335
      8       3.1117     -0.00181
      9       5.5780     -0.00000
     10       6.5509     -0.00000
     11       8.3102      0.00000
     12       9.9273      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2666      1.00000
      2      -3.9439      1.00000
      3      -2.2595      1.00000
      4      -1.9714      1.00000
      5      -0.9030      1.00000
      6       0.9173      1.00000
      7       1.5294      1.00000
      8       4.0083     -0.00000
      9       4.1864     -0.00000
     10       6.8808     -0.00000
     11       7.6027     -0.00000
     12       9.8035      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2666      1.00000
      2      -3.9439      1.00000
      3      -2.2595      1.00000
      4      -1.9714      1.00000
      5      -0.9030      1.00000
      6       0.9173      1.00000
      7       1.5294      1.00000
      8       4.0083     -0.00000
      9       4.1864     -0.00000
     10       6.8808     -0.00000
     11       7.6027     -0.00000
     12       9.8035      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2666      1.00000
      2      -3.9439      1.00000
      3      -2.2595      1.00000
      4      -1.9714      1.00000
      5      -0.9030      1.00000
      6       0.9173      1.00000
      7       1.5294      1.00000
      8       4.0083     -0.00000
      9       4.1864     -0.00000
     10       6.8808     -0.00000
     11       7.6027     -0.00000
     12       9.8035      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8599      1.00000
      2      -3.8023      1.00000
      3      -2.5734      1.00000
      4      -2.4978      1.00000
      5      -0.7944      1.00000
      6       0.0540      1.00000
      7       2.3613      1.03328
      8       2.7257      0.14857
      9       5.2664     -0.00000
     10       5.7038     -0.00000
     11       8.4707      0.00000
     12       9.5415      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8599      1.00000
      2      -3.8023      1.00000
      3      -2.5734      1.00000
      4      -2.4978      1.00000
      5      -0.7944      1.00000
      6       0.0540      1.00000
      7       2.3613      1.03328
      8       2.7257      0.14858
      9       5.2664     -0.00000
     10       5.7038     -0.00000
     11       8.4707      0.00000
     12       9.7252      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8599      1.00000
      2      -3.8023      1.00000
      3      -2.5734      1.00000
      4      -2.4978      1.00000
      5      -0.7944      1.00000
      6       0.0540      1.00000
      7       2.3613      1.03328
      8       2.7257      0.14857
      9       5.2664     -0.00000
     10       5.7038     -0.00000
     11       8.4707      0.00000
     12       9.0349      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1409      1.00000
      2      -9.8305      1.00000
      3      -7.7936      1.00000
      4      -4.9933      1.00000
      5      -1.6880      1.00000
      6       2.2621      1.01247
      7       4.7191     -0.00000
      8       6.7105     -0.00000
      9       6.9100     -0.00000
     10      10.9758      0.00000
     11      11.0284      0.00000
     12      12.9359      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1409      1.00000
      2      -9.8305      1.00000
      3      -7.7936      1.00000
      4      -4.9933      1.00000
      5      -1.6880      1.00000
      6       2.2621      1.01247
      7       4.7191     -0.00000
      8       6.7105     -0.00000
      9       6.9100     -0.00000
     10      10.9758      0.00000
     11      11.0284      0.00000
     12      12.9372      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1409      1.00000
      2      -9.8305      1.00000
      3      -7.7936      1.00000
      4      -4.9933      1.00000
      5      -1.6880      1.00000
      6       2.2621      1.01247
      7       4.7191     -0.00000
      8       6.7105     -0.00000
      9       6.9100     -0.00000
     10      10.9758      0.00000
     11      11.0284      0.00000
     12      12.9442      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80236
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1854      0.00000
     12      11.5064      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80236
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1854      0.00000
     12      11.5064      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80236
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1854      0.00000
     12      11.5064      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80236
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1854      0.00000
     12      11.5064      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80236
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1854      0.00000
     12      11.5064      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8409      1.00000
      2      -9.5295      1.00000
      3      -7.4905      1.00000
      4      -4.6844      1.00000
      5      -1.3847      1.00000
      6       2.5552      0.80236
      7       4.9723     -0.00000
      8       6.9559     -0.00000
      9       7.1466     -0.00000
     10      10.7145      0.00000
     11      11.1854      0.00000
     12      11.5064      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0529      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0529      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0529      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0529      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0529      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3906      1.00000
      2      -9.0778      1.00000
      3      -7.0359      1.00000
      4      -4.2220      1.00000
      5      -0.9318      1.00000
      6       2.9790     -0.01718
      7       5.3423     -0.00000
      8       7.2878     -0.00000
      9       7.4633     -0.00000
     10       8.8545      0.00000
     11       9.7462      0.00000
     12      11.0529      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
      7       5.7465     -0.00000
      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5032      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
      7       5.7465     -0.00000
      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5032      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
      7       5.7465     -0.00000
      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5033      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
      7       5.7465     -0.00000
      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5032      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
      7       5.7465     -0.00000
      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5032      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7900      1.00000
      2      -8.4751      1.00000
      3      -6.4295      1.00000
      4      -3.6077      1.00000
      5      -0.3330      1.00000
      6       3.5060     -0.00000
      7       5.7465     -0.00000
      8       6.6239     -0.00000
      9       7.6894     -0.00000
     10       7.8940     -0.00000
     11       8.1724      0.00000
     12       9.5032      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4386      0.00000
     12       9.2938      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4386      0.00000
     12       9.2942      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4386      0.00000
     12       9.2923      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4386      0.00000
     12       9.2925      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4386      0.00000
     12       9.2939      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0385      1.00000
      2      -7.7209      1.00000
      3      -5.6713      1.00000
      4      -2.8442      1.00000
      5       0.4000      1.00000
      6       3.8694     -0.00000
      7       4.7758     -0.00000
      8       5.7899     -0.00000
      9       6.5420     -0.00000
     10       7.5644     -0.00000
     11       8.4386      0.00000
     12       9.2905      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95999
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95999
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95999
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95999
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95999
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1355      1.00000
      2      -6.8146      1.00000
      3      -4.7619      1.00000
      4      -1.9411      1.00000
      5       1.1820      1.00000
      6       2.4923      0.95999
      7       3.7733     -0.00000
      8       5.2030     -0.00000
      9       5.6758     -0.00000
     10       7.3011     -0.00000
     11       8.1325      0.00000
     12       8.9525      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63651
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63651
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63651
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63651
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63651
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0800      1.00000
      2      -5.7559      1.00000
      3      -3.7046      1.00000
      4      -0.9534      1.00000
      5       0.4463      1.00000
      6       1.8095      1.00000
      7       2.5998      0.63651
      8       3.8869     -0.00000
      9       5.9848     -0.00000
     10       6.5425     -0.00000
     11       8.1020      0.00000
     12       8.7674      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8713      1.00000
      2      -4.5464      1.00000
      3      -2.5175      1.00000
      4      -1.3866      1.00000
      5      -0.2574      1.00000
      6       0.7374      1.00000
      7       2.1906      1.00385
      8       3.6193     -0.00000
      9       4.8416     -0.00000
     10       7.0334     -0.00000
     11       7.6535     -0.00000
     12       8.5454      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5107      1.00000
      2      -3.1958      1.00000
      3      -3.0032      1.00000
      4      -1.8043      1.00000
      5      -1.0765      1.00000
      6       0.5234      1.00000
      7       1.9119      1.00000
      8       3.3318     -0.00000
      9       4.8328     -0.00000
     10       6.2454     -0.00000
     11       7.9851     -0.00000
     12       8.4868      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4657      1.00000
      2      -9.1531      1.00000
      3      -7.1117      1.00000
      4      -4.2990      1.00000
      5      -1.0071      1.00000
      6       2.9103     -0.03219
      7       5.2830     -0.00000
      8       7.2512     -0.00000
      9       7.4219     -0.00000
     10       9.9201      0.00000
     11       9.9291      0.00000
     12      10.8175      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4657      1.00000
      2      -9.1531      1.00000
      3      -7.1117      1.00000
      4      -4.2990      1.00000
      5      -1.0071      1.00000
      6       2.9103     -0.03219
      7       5.2830     -0.00000
      8       7.2512     -0.00000
      9       7.4219     -0.00000
     10       9.9202      0.00000
     11       9.9291      0.00000
     12      10.8103      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4657      1.00000
      2      -9.1531      1.00000
      3      -7.1117      1.00000
      4      -4.2990      1.00000
      5      -1.0071      1.00000
      6       2.9103     -0.03219
      7       5.2830     -0.00000
      8       7.2512     -0.00000
      9       7.4219     -0.00000
     10       9.9202      0.00000
     11       9.9291      0.00000
     12      10.8166      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2134      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2134      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2134      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2134      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2134      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9402      1.00000
      2      -8.6258      1.00000
      3      -6.5812      1.00000
      4      -3.7610      1.00000
      5      -0.4816      1.00000
      6       3.3847     -0.00000
      7       5.6935     -0.00000
      8       7.4043     -0.00000
      9       7.6974     -0.00000
     10       8.2832      0.00000
     11       8.8693      0.00000
     12       9.2134      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4687      0.00000
     12       8.7703      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4687      0.00000
     12       8.7703      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4687      0.00000
     12       8.7703      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4687      0.00000
     12       8.7703      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4687      0.00000
     12       8.7703      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2640      1.00000
      2      -7.9473      1.00000
      3      -5.8988      1.00000
      4      -3.0723      1.00000
      5       0.1851      1.00000
      6       3.9171     -0.00000
      7       5.5855     -0.00000
      8       6.4369     -0.00000
      9       6.8833     -0.00000
     10       7.9936     -0.00000
     11       8.4687      0.00000
     12       8.7703      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4366      1.00000
      2      -7.1169      1.00000
      3      -5.0649      1.00000
      4      -2.2385      1.00000
      5       0.9662      1.00000
      6       3.4709     -0.00000
      7       4.6776     -0.00000
      8       5.1801     -0.00000
      9       6.6512     -0.00000
     10       7.0466     -0.00000
     11       7.7442     -0.00000
     12       8.7369      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3588      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3588      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3588      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3588      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3588      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4571      1.00000
      2      -6.1342      1.00000
      3      -4.0811      1.00000
      4      -1.2803      1.00000
      5       1.3331      1.00000
      6       2.1842      1.00341
      7       3.0779     -0.00362
      8       4.9026     -0.00000
      9       5.6669     -0.00000
     10       7.0841     -0.00000
     11       7.4717     -0.00000
     12       8.3588      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2731      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2731      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2731      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2731      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2731      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3245      1.00000
      2      -4.9996      1.00000
      3      -2.9554      1.00000
      4      -0.5430      1.00000
      5      -0.0108      1.00000
      6       1.2537      1.00000
      7       3.0538     -0.00556
      8       3.3167     -0.00001
      9       5.6609     -0.00000
     10       6.5013     -0.00000
     11       7.1574     -0.00000
     12       8.2731      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7498      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7498      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7498      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7498      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7498      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0391      1.00000
      2      -3.7175      1.00000
      3      -2.0332      1.00000
      4      -1.7498      1.00000
      5      -0.6808      1.00000
      6       1.1336      1.00000
      7       1.7377      1.00000
      8       4.1627     -0.00000
      9       4.3758     -0.00000
     10       6.5624     -0.00000
     11       7.0713     -0.00000
     12       7.8149     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6336      1.00000
      2      -3.5736      1.00000
      3      -2.3456      1.00000
      4      -2.2770      1.00000
      5      -0.5781      1.00000
      6       0.2794      1.00000
      7       2.5577      0.79269
      8       2.9125     -0.03172
      9       5.3749     -0.00000
     10       5.8847     -0.00000
     11       6.6892     -0.00000
     12       7.8662     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6336      1.00000
      2      -3.5736      1.00000
      3      -2.3456      1.00000
      4      -2.2770      1.00000
      5      -0.5781      1.00000
      6       0.2794      1.00000
      7       2.5577      0.79269
      8       2.9125     -0.03172
      9       5.3749     -0.00000
     10       5.8847     -0.00000
     11       6.6892     -0.00000
     12       7.8662     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6336      1.00000
      2      -3.5736      1.00000
      3      -2.3456      1.00000
      4      -2.2770      1.00000
      5      -0.5781      1.00000
      6       0.2794      1.00000
      7       2.5577      0.79269
      8       2.9125     -0.03172
      9       5.3749     -0.00000
     10       5.8847     -0.00000
     11       6.6892     -0.00000
     12       7.8662     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3392      1.00000
      2      -8.0227      1.00000
      3      -5.9747      1.00000
      4      -3.1486      1.00000
      5       0.1128      1.00000
      6       3.8865     -0.00000
      7       6.0364     -0.00000
      8       6.9769     -0.00000
      9       7.0162     -0.00000
     10       8.0257     -0.00000
     11       8.1136      0.00000
     12       8.4360      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3392      1.00000
      2      -8.0227      1.00000
      3      -5.9747      1.00000
      4      -3.1486      1.00000
      5       0.1128      1.00000
      6       3.8865     -0.00000
      7       6.0364     -0.00000
      8       6.9769     -0.00000
      9       7.0162     -0.00000
     10       8.0257     -0.00000
     11       8.1136      0.00000
     12       8.4360      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3392      1.00000
      2      -8.0227      1.00000
      3      -5.9747      1.00000
      4      -3.1486      1.00000
      5       0.1128      1.00000
      6       3.8865     -0.00000
      7       6.0364     -0.00000
      8       6.9769     -0.00000
      9       7.0162     -0.00000
     10       8.0257     -0.00000
     11       8.1136      0.00000
     12       8.4360      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5871      1.00000
      2      -7.2680      1.00000
      3      -5.2165      1.00000
      4      -2.3885      1.00000
      5       0.8379      1.00000
      6       4.2517     -0.00000
      7       5.1006     -0.00000
      8       6.0533     -0.00000
      9       6.3633     -0.00000
     10       7.0266     -0.00000
     11       7.3390     -0.00000
     12       8.0602     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6832      1.00000
      2      -6.3612      1.00000
      3      -4.3077      1.00000
      4      -1.4917      1.00000
      5       1.6074      1.00000
      6       2.9207     -0.03016
      7       4.1807     -0.00000
      8       5.1911     -0.00000
      9       5.9582     -0.00000
     10       6.0620     -0.00000
     11       7.0462     -0.00000
     12       7.7110     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6266      1.00000
      2      -5.3022      1.00000
      3      -3.2525      1.00000
      4      -0.5155      1.00000
      5       0.8887      1.00000
      6       2.2320      1.00792
      7       2.9979     -0.01343
      8       4.2651     -0.00000
      9       5.0990     -0.00000
     10       6.2288     -0.00000
     11       6.6911     -0.00000
     12       7.3637     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4167      1.00000
      2      -4.0931      1.00000
      3      -2.0703      1.00000
      4      -0.9383      1.00000
      5       0.1772      1.00000
      6       1.1666      1.00000
      7       2.5931      0.66226
      8       3.9320     -0.00000
      9       4.7627     -0.00000
     10       5.4340     -0.00000
     11       6.4235     -0.00000
     12       7.6723     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0557      1.00000
      2      -2.7449      1.00000
      3      -2.5490      1.00000
      4      -1.3621      1.00000
      5      -0.6347      1.00000
      6       0.9607      1.00000
      7       2.2915      1.01837
      8       3.6066     -0.00000
      9       4.7188     -0.00000
     10       5.4556     -0.00000
     11       6.2024     -0.00000
     12       6.8260     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7586      1.00000
      2      -6.4368      1.00000
      3      -4.3833      1.00000
      4      -1.5636      1.00000
      5       1.5906      1.00000
      6       4.0003     -0.00000
      7       4.2235     -0.00000
      8       5.2499     -0.00000
      9       5.4582     -0.00000
     10       6.0078     -0.00000
     11       7.1063     -0.00000
     12       7.4291     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7586      1.00000
      2      -6.4368      1.00000
      3      -4.3833      1.00000
      4      -1.5636      1.00000
      5       1.5906      1.00000
      6       4.0003     -0.00000
      7       4.2235     -0.00000
      8       5.2499     -0.00000
      9       5.4582     -0.00000
     10       6.0078     -0.00000
     11       7.1063     -0.00000
     12       7.4291     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7586      1.00000
      2      -6.4368      1.00000
      3      -4.3833      1.00000
      4      -1.5636      1.00000
      5       1.5906      1.00000
      6       4.0003     -0.00000
      7       4.2235     -0.00000
      8       5.2499     -0.00000
      9       5.4582     -0.00000
     10       6.0078     -0.00000
     11       7.1063     -0.00000
     12       7.4291     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7775      1.00000
      2      -5.4535      1.00000
      3      -3.4020      1.00000
      4      -0.6218      1.00000
      5       1.9556      1.00001
      6       2.7461      0.09409
      7       3.6687     -0.00000
      8       3.7908     -0.00000
      9       4.8667     -0.00000
     10       5.5690     -0.00000
     11       6.5628     -0.00000
     12       7.0311     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6434      1.00000
      2      -4.3192      1.00000
      3      -2.2822      1.00000
      4       0.1087      1.00000
      5       0.6349      1.00000
      6       1.8748      1.00000
      7       3.1258     -0.00134
      8       3.6635     -0.00000
      9       4.0480     -0.00000
     10       4.7867     -0.00000
     11       6.3868     -0.00000
     12       6.9215     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3569      1.00000
      2      -3.0395      1.00000
      3      -1.3573      1.00000
      4      -1.0892      1.00000
      5      -0.0198      1.00000
      6       1.7361      1.00000
      7       2.2474      1.01010
      8       3.0572     -0.00525
      9       4.3015     -0.00000
     10       5.0869     -0.00000
     11       5.3192     -0.00000
     12       6.5433     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9556      1.00000
      2      -2.8888      1.00000
      3      -1.6651      1.00000
      4      -1.6160      1.00000
      5       0.0638      1.00000
      6       0.9357      1.00000
      7       2.7137      0.18572
      8       2.9404     -0.02584
      9       3.8785     -0.00000
     10       4.7523     -0.00000
     11       6.1573     -0.00000
     12       6.4957     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9556      1.00000
      2      -2.8888      1.00000
      3      -1.6651      1.00000
      4      -1.6160      1.00000
      5       0.0638      1.00000
      6       0.9357      1.00000
      7       2.7137      0.18573
      8       2.9404     -0.02584
      9       3.8785     -0.00000
     10       4.7523     -0.00000
     11       6.1573     -0.00000
     12       6.4957     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9556      1.00000
      2      -2.8888      1.00000
      3      -1.6651      1.00000
      4      -1.6160      1.00000
      5       0.0638      1.00000
      6       0.9357      1.00000
      7       2.7137      0.18572
      8       2.9404     -0.02584
      9       3.8785     -0.00000
     10       4.7523     -0.00000
     11       6.1573     -0.00000
     12       6.4957     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7189      1.00000
      2      -4.3946      1.00000
      3      -2.3543      1.00000
      4       0.3010      1.00000
      5       1.5988      1.00000
      6       1.9062      1.00000
      7       2.9800     -0.01697
      8       3.2547     -0.00005
      9       4.0160     -0.00000
     10       4.8143     -0.00000
     11       5.6401     -0.00000
     12       7.2654     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7189      1.00000
      2      -4.3946      1.00000
      3      -2.3543      1.00000
      4       0.3010      1.00000
      5       1.5988      1.00000
      6       1.9062      1.00000
      7       2.9800     -0.01697
      8       3.2547     -0.00005
      9       4.0160     -0.00000
     10       4.8143     -0.00000
     11       5.6401     -0.00000
     12       7.2654     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7189      1.00000
      2      -4.3946      1.00000
      3      -2.3543      1.00000
      4       0.3010      1.00000
      5       1.5988      1.00000
      6       1.9062      1.00000
      7       2.9800     -0.01697
      8       3.2547     -0.00005
      9       4.0160     -0.00000
     10       4.8143     -0.00000
     11       5.6401     -0.00000
     12       7.2654     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5076      1.00000
      2      -3.1882      1.00000
      3      -1.1883      1.00000
      4      -0.0478      1.00000
      5       0.9821      1.00000
      6       1.3649      1.00000
      7       2.0337      1.00010
      8       2.7773      0.03215
      9       3.6848     -0.00000
     10       4.9222     -0.00000
     11       5.1038     -0.00000
     12       6.3168     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1474      1.00000
      2      -1.8486      1.00000
      3      -1.6444      1.00000
      4      -0.4862      1.00000
      5       0.2207      1.00000
      6       1.2609      1.00000
      7       1.7664      1.00000
      8       2.3285      1.02668
      9       3.6811     -0.00000
     10       4.6267     -0.00000
     11       5.1592     -0.00000
     12       6.1540     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2220      1.00000
      2      -1.9183      1.00000
      3      -0.2785      1.00000
      4      -0.2055      1.00000
      5      -0.0580      1.00000
      6       0.8920      1.00000
      7       1.2357      1.00000
      8       2.4884      0.96608
      9       3.6860     -0.00000
     10       3.8352     -0.00000
     11       5.9778     -0.00000
     12       6.2121     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2220      1.00000
      2      -1.9183      1.00000
      3      -0.2785      1.00000
      4      -0.2055      1.00000
      5      -0.0580      1.00000
      6       0.8920      1.00000
      7       1.2357      1.00000
      8       2.4884      0.96608
      9       3.6860     -0.00000
     10       3.8352     -0.00000
     11       5.9778     -0.00000
     12       6.2126     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2220      1.00000
      2      -1.9183      1.00000
      3      -0.2785      1.00000
      4      -0.2055      1.00000
      5      -0.0580      1.00000
      6       0.8920      1.00000
      7       1.2357      1.00000
      8       2.4884      0.96608
      9       3.6860     -0.00000
     10       3.8352     -0.00000
     11       5.9776     -0.00000
     12       6.2106     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8321      1.00000
      2      -1.7552      1.00000
      3      -0.5495      1.00000
      4      -0.5342      1.00000
      5      -0.3044      1.00000
      6       0.6913      1.00000
      7       1.4298      1.00000
      8       1.7991      1.00000
      9       3.4758     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8321      1.00000
      2      -1.7552      1.00000
      3      -0.5495      1.00000
      4      -0.5342      1.00000
      5      -0.3044      1.00000
      6       0.6913      1.00000
      7       1.4298      1.00000
      8       1.7991      1.00000
      9       3.4758     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8321      1.00000
      2      -1.7552      1.00000
      3      -0.5495      1.00000
      4      -0.5342      1.00000
      5      -0.3044      1.00000
      6       0.6913      1.00000
      7       1.4298      1.00000
      8       1.7991      1.00000
      9       3.4758     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000


--------------------------------------------------------------------------------------------------------


 soft charge-density along one line, spin component           1
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 soft charge-density along one line, spin component           2
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 pseudopotential strength for first ion, spin component:           1
  8.085  13.803  -0.000  -0.002   0.000  -0.000  -0.006   0.000
 13.803  23.557  -0.000  -0.003   0.000  -0.000  -0.010   0.000
 -0.000  -0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880   0.000  -0.000   5.472   0.000
  0.000   0.000   0.000   0.000   1.879   0.000   0.000   5.469
 -0.000  -0.000   5.469  -0.000   0.000  15.775  -0.000   0.000
 -0.006  -0.010  -0.000   5.472   0.000  -0.000  15.784   0.000
  0.000   0.000   0.000   0.000   5.469   0.000   0.000  15.775
 pseudopotential strength for first ion, spin component:           2
  8.085  13.803  -0.000  -0.002   0.000  -0.000  -0.006   0.000
 13.803  23.557  -0.000  -0.003   0.000  -0.000  -0.010   0.000
 -0.000  -0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880  -0.000  -0.000   5.472  -0.000
  0.000   0.000   0.000  -0.000   1.879   0.000  -0.000   5.469
 -0.000  -0.000   5.469  -0.000   0.000  15.775  -0.000   0.000
 -0.006  -0.010  -0.000   5.472  -0.000  -0.000  15.784  -0.000
  0.000   0.000   0.000  -0.000   5.469   0.000  -0.000  15.775
 total augmentation occupancy for first ion, spin component:           1
116.836 -62.396   0.000  -0.164   0.000  -0.000  -0.010  -0.000
-62.396  33.323  -0.000   0.077  -0.000   0.000   0.007   0.000
  0.000  -0.000   2.102   0.000  -0.000  -0.326  -0.000   0.000
 -0.164   0.077   0.000   1.665  -0.000  -0.000  -0.256  -0.000
  0.000  -0.000  -0.000  -0.000   2.102   0.000   0.000  -0.326
 -0.000   0.000  -0.326  -0.000   0.000   0.051   0.000  -0.000
 -0.010   0.007  -0.000  -0.256   0.000   0.000   0.039   0.000
 -0.000   0.000   0.000  -0.000  -0.326  -0.000   0.000   0.051
 total augmentation occupancy for first ion, spin component:           2
 -0.000   0.000  -0.000   0.000   0.000  -0.000  -0.000  -0.000
  0.000  -0.000   0.000  -0.000  -0.000   0.000   0.000   0.000
 -0.000   0.000  -0.000  -0.000   0.000  -0.000   0.000  -0.000
  0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000  -0.000
  0.000  -0.000   0.000   0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000  -0.000  -0.000   0.000   0.000   0.000   0.000


------------------------ aborting loop because EDIFF is reached ----------------------------------------


    FORLOC:  cpu time      0.0008: real time      0.0008
    FORHF :  cpu time   1054.3774: real time   1058.6738
    FORNL :  cpu time      0.2587: real time      0.2602
    FORCOR:  cpu time      1.1752: real time      1.1786
    OFIELD:  cpu time      0.0001: real time      0.0001

 VOLUME and BASIS-vectors are now :
 -----------------------------------------------------------------------------
  energy-cutoff  :      400.00
  volume of cell :      120.20
      direct lattice vectors                 reciprocal lattice vectors
     2.857459769  0.000000000  0.000000000     0.349961183 -0.202050183  0.000000000
     1.428729885  2.474632750  0.000000000     0.000000000  0.404100366  0.000000000
     0.000000000  0.000000000 16.999318395     0.000000000  0.000000000  0.058825888

  length of vectors
     2.857459769  2.857459769 16.999318395     0.404100366  0.404100366  0.058825888


 FORCES acting on ions:
    Electron-Ion                     Ewald-Force                    Non-Local-Force
 -----------------------------------------------------------------------------------------------
   -.465E-06 0.872E-06 0.156E+03   0.407E-13 0.245E-13 -.155E+03   0.428E-06 -.911E-06 -.112E+01
   -.529E-06 -.535E-06 0.519E+02   -.134E-12 -.777E-13 -.520E+02   0.527E-06 0.358E-06 0.185E+00
   -.429E-06 0.122E-05 -.524E+02   0.136E-12 0.803E-13 0.523E+02   0.682E-06 -.117E-05 -.103E+00
   0.197E-06 -.829E-06 -.155E+03   -.413E-13 -.223E-13 0.155E+03   -.231E-06 0.838E-06 0.104E+01
 -----------------------------------------------------------------------------------------------
   -.108E-05 0.879E-06 -.146E-02   0.721E-15 0.484E-14 0.000E+00   0.141E-05 -.888E-06 0.250E-02
 
 
 POSITION                                       TOTAL-FORCE (eV/Angst)
 -----------------------------------------------------------------------------------
      0.00000      0.00000      0.00000         0.000000      0.000000     -0.110475
      1.42873      0.82488      2.33311        -0.000001     -0.000000      0.163265
      2.85746      1.64976      4.65679         0.000000      0.000000     -0.123815
      0.00000      0.00000      7.00493         0.000000      0.000000      0.071025
 -----------------------------------------------------------------------------------
    total drift:                                0.000000     -0.000000      0.001403


--------------------------------------------------------------------------------------------------------



  FREE ENERGIE OF THE ION-ELECTRON SYSTEM (eV)
  ---------------------------------------------------
  free  energy   TOTEN  =       -10.94797090 eV

  energy  without entropy=      -10.94799470  energy(sigma->0) =      -10.94797883
 
 d Force = 0.2029864E-02[ 0.157E-02, 0.249E-02]  d Energy = 0.2071345E-02-0.415E-04
 d Force = 0.3774605E+00[ 0.375E+00, 0.380E+00]  d Ewald  = 0.3774616E+00-0.115E-05


--------------------------------------------------------------------------------------------------------


    POTLOK:  cpu time      1.1739: real time      1.1773


--------------------------------------------------------------------------------------------------------


 Quasi-Newton relaxation of ions (Broydens 2nd method)
  g(Force)  = 0.983E-03   g(Stress)= 0.000E+00

 retain information from N=  1 steps
 eigenvalues of (default step * inverse Hessian matrix)
  average eigenvalue of G=   2.6838
 eigenvalue spectrum of G is  2.6838


--------------------------------------------------------------------------------------------------------


    WAVPRE:  cpu time      0.0038: real time      0.1786
    FEWALD:  cpu time      0.0002: real time      0.0002
    ORTHCH:  cpu time      0.0926: real time      0.0929
    POTLOK:  cpu time      1.1768: real time      1.1802
    EDDIAG:  cpu time   1293.3043: real time   1298.6281
    CHARGE:  cpu time      0.2422: real time      0.2434
 writing wavefunctions
     LOOP+:  cpu time  17860.1755: real time  17933.7918


--------------------------------------- Iteration      3(   1)  ---------------------------------------


    POTLOK:  cpu time      0.3891: real time      0.3915
    SETDIJ:  cpu time      0.7910: real time      0.7930
    TRIAL :  cpu time   1290.7976: real time   1296.0302
    CORREC:  cpu time      0.0067: real time      0.0067
    CHARGE:  cpu time      0.2420: real time      0.2430
    --------------------------------------------
      LOOP:  cpu time   1292.2359: real time   1297.4742

 eigenvalue-minimisations  :     0
 total energy-change (2. order) : 0.7021659E-02  (-0.4990181E-02)
 number of electron      12.0000000 magnetization      -0.0000008
 augmentation part       -0.0019742 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -508.63428086
  -exchange      EXHF   =        26.48318766
  -V(xc)+E(xc)   XCENC  =       -66.89320890
  PAW double counting   =     81912.59799344   -81831.83426582
  entropy T*S    EENTRO =         0.00034951
  eigenvalues    EBANDS =       -34.21993072
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94094069 eV

  energy without entropy =      -10.94129020  energy(sigma->0) =      -10.94105719
  exchange ACFDT corr.  =        -0.00055549  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(   2)  ---------------------------------------


    POTLOK:  cpu time      0.3884: real time      0.3898
    SETDIJ:  cpu time      0.7910: real time      0.7931
    TRIAL :  cpu time   1290.8355: real time   1296.1124
    CORREC:  cpu time      0.0064: real time      0.0065
    CHARGE:  cpu time      0.2423: real time      0.2433
    --------------------------------------------
      LOOP:  cpu time   1292.2641: real time   1297.5455

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.3961616E-02  (-0.3612362E-02)
 number of electron      12.0000000 magnetization      -0.0000008
 augmentation part       -0.0019514 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -508.26308942
  -exchange      EXHF   =        26.47938471
  -V(xc)+E(xc)   XCENC  =       -66.89467909
  PAW double counting   =     81908.77396635   -81828.01010635
  entropy T*S    EENTRO =         0.00039023
  eigenvalues    EBANDS =       -34.58998678
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94490230 eV

  energy without entropy =      -10.94529254  energy(sigma->0) =      -10.94503238
  exchange ACFDT corr.  =        -0.00052657  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(   3)  ---------------------------------------


    POTLOK:  cpu time      0.3857: real time      0.3872
    SETDIJ:  cpu time      0.7899: real time      0.7920
    TRIAL :  cpu time   1293.5564: real time   1298.7584
    CORREC:  cpu time      0.0065: real time      0.0065
    CHARGE:  cpu time      0.2431: real time      0.2441
    --------------------------------------------
      LOOP:  cpu time   1294.9819: real time   1300.1885

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.2480685E-02  (-0.1334931E-02)
 number of electron      12.0000000 magnetization      -0.0000007
 augmentation part       -0.0019453 magnetization       0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -507.93643654
  -exchange      EXHF   =        26.47596350
  -V(xc)+E(xc)   XCENC  =       -66.89604342
  PAW double counting   =     81906.44855921   -81825.68458945
  entropy T*S    EENTRO =         0.00040581
  eigenvalues    EBANDS =       -34.91448529
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94738299 eV

  energy without entropy =      -10.94778880  energy(sigma->0) =      -10.94751826
  exchange ACFDT corr.  =        -0.00051670  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(   4)  ---------------------------------------


    POTLOK:  cpu time      0.3861: real time      0.3875
    SETDIJ:  cpu time      0.7897: real time      0.7917
    TRIAL :  cpu time   1300.4620: real time   1305.7443
    CORREC:  cpu time      0.0068: real time      0.0068
    CHARGE:  cpu time      0.2426: real time      0.2436
    --------------------------------------------
      LOOP:  cpu time   1301.8875: real time   1307.1743

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.8364866E-03  (-0.6265778E-03)
 number of electron      12.0000000 magnetization      -0.0000006
 augmentation part       -0.0019487 magnetization       0.0000001

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -507.83638207
  -exchange      EXHF   =        26.47502228
  -V(xc)+E(xc)   XCENC  =       -66.89653587
  PAW double counting   =     81905.06043643   -81824.29653323
  entropy T*S    EENTRO =         0.00039861
  eigenvalues    EBANDS =       -35.01389160
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94821947 eV

  energy without entropy =      -10.94861808  energy(sigma->0) =      -10.94835234
  exchange ACFDT corr.  =        -0.00051397  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(   5)  ---------------------------------------


    POTLOK:  cpu time      0.3856: real time      0.3870
    SETDIJ:  cpu time      0.7906: real time      0.7927
    TRIAL :  cpu time   1291.0829: real time   1296.3351
    CORREC:  cpu time      0.0068: real time      0.0068
    CHARGE:  cpu time      0.2423: real time      0.2433
    --------------------------------------------
      LOOP:  cpu time   1292.5088: real time   1297.7656

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.4644832E-03  (-0.4588724E-03)
 number of electron      12.0000000 magnetization      -0.0000005
 augmentation part       -0.0019527 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -507.89074132
  -exchange      EXHF   =        26.47590721
  -V(xc)+E(xc)   XCENC  =       -66.89634217
  PAW double counting   =     81907.19468349   -81826.43089219
  entropy T*S    EENTRO =         0.00038003
  eigenvalues    EBANDS =       -34.96095636
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94868396 eV

  energy without entropy =      -10.94906399  energy(sigma->0) =      -10.94881063
  exchange ACFDT corr.  =        -0.00051453  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(   6)  ---------------------------------------


    POTLOK:  cpu time      0.3863: real time      0.3877
    SETDIJ:  cpu time      0.7895: real time      0.7916
    TRIAL :  cpu time   1295.0577: real time   1300.3411
    CORREC:  cpu time      0.0064: real time      0.0064
    CHARGE:  cpu time      0.2432: real time      0.2442
    --------------------------------------------
      LOOP:  cpu time   1296.4835: real time   1301.7713

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.3466829E-03  (-0.2600591E-03)
 number of electron      12.0000000 magnetization      -0.0000004
 augmentation part       -0.0019542 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -507.97644672
  -exchange      EXHF   =        26.47727868
  -V(xc)+E(xc)   XCENC  =       -66.89591973
  PAW double counting   =     81914.28087350   -81833.51725888
  entropy T*S    EENTRO =         0.00036018
  eigenvalues    EBANDS =       -34.87719629
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94903064 eV

  energy without entropy =      -10.94939082  energy(sigma->0) =      -10.94915070
  exchange ACFDT corr.  =        -0.00052434  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(   7)  ---------------------------------------


    POTLOK:  cpu time      0.3857: real time      0.3871
    SETDIJ:  cpu time      0.7905: real time      0.7926
    TRIAL :  cpu time   1296.6392: real time   1301.8947
    CORREC:  cpu time      0.0066: real time      0.0066
    CHARGE:  cpu time      0.2427: real time      0.2437
    --------------------------------------------
      LOOP:  cpu time   1298.0651: real time   1303.3252

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1900680E-03  (-0.1267652E-03)
 number of electron      12.0000000 magnetization      -0.0000004
 augmentation part       -0.0019518 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -508.03215587
  -exchange      EXHF   =        26.47833381
  -V(xc)+E(xc)   XCENC  =       -66.89556995
  PAW double counting   =     81924.89774776   -81844.13420765
  entropy T*S    EENTRO =         0.00034447
  eigenvalues    EBANDS =       -34.82298776
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94922071 eV

  energy without entropy =      -10.94956518  energy(sigma->0) =      -10.94933553
  exchange ACFDT corr.  =        -0.00053361  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(   8)  ---------------------------------------


    POTLOK:  cpu time      0.3856: real time      0.3870
    SETDIJ:  cpu time      0.7911: real time      0.7931
    TRIAL :  cpu time   1289.5750: real time   1294.7866
    CORREC:  cpu time      0.0067: real time      0.0068
    CHARGE:  cpu time      0.2432: real time      0.2443
    --------------------------------------------
      LOOP:  cpu time   1291.0020: real time   1296.2180

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.9247223E-04  (-0.7296009E-04)
 number of electron      12.0000000 magnetization      -0.0000004
 augmentation part       -0.0019448 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -508.05487769
  -exchange      EXHF   =        26.47886818
  -V(xc)+E(xc)   XCENC  =       -66.89538822
  PAW double counting   =     81938.18128664   -81857.41777989
  entropy T*S    EENTRO =         0.00033424
  eigenvalues    EBANDS =       -34.80102544
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94931318 eV

  energy without entropy =      -10.94964742  energy(sigma->0) =      -10.94942459
  exchange ACFDT corr.  =        -0.00054059  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(   9)  ---------------------------------------


    POTLOK:  cpu time      0.3870: real time      0.3884
    SETDIJ:  cpu time      0.7917: real time      0.7938
    TRIAL :  cpu time   1293.5211: real time   1298.7715
    CORREC:  cpu time      0.0066: real time      0.0067
    CHARGE:  cpu time      0.2419: real time      0.2430
    --------------------------------------------
      LOOP:  cpu time   1294.9487: real time   1300.2037

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.5796156E-04  (-0.5077974E-04)
 number of electron      12.0000000 magnetization      -0.0000004
 augmentation part       -0.0019345 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -508.05882724
  -exchange      EXHF   =        26.47893745
  -V(xc)+E(xc)   XCENC  =       -66.89536199
  PAW double counting   =     81953.69373460   -81872.93018841
  entropy T*S    EENTRO =         0.00032850
  eigenvalues    EBANDS =       -34.79725857
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94937114 eV

  energy without entropy =      -10.94969964  energy(sigma->0) =      -10.94948064
  exchange ACFDT corr.  =        -0.00054502  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(  10)  ---------------------------------------


    POTLOK:  cpu time      0.3856: real time      0.3870
    SETDIJ:  cpu time      0.7907: real time      0.7927
    TRIAL :  cpu time   1292.0332: real time   1297.2909
    CORREC:  cpu time      0.0067: real time      0.0067
    CHARGE:  cpu time      0.2430: real time      0.2440
    --------------------------------------------
      LOOP:  cpu time   1293.4596: real time   1298.7217

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.4047962E-04  (-0.3063091E-04)
 number of electron      12.0000000 magnetization      -0.0000004
 augmentation part       -0.0019236 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -508.05444982
  -exchange      EXHF   =        26.47873247
  -V(xc)+E(xc)   XCENC  =       -66.89542910
  PAW double counting   =     81970.31189872   -81889.54828708
  entropy T*S    EENTRO =         0.00032550
  eigenvalues    EBANDS =       -34.80146407
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94941162 eV

  energy without entropy =      -10.94973712  energy(sigma->0) =      -10.94952012
  exchange ACFDT corr.  =        -0.00054725  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(  11)  ---------------------------------------


    POTLOK:  cpu time      0.3861: real time      0.3875
    SETDIJ:  cpu time      0.7892: real time      0.7912
    TRIAL :  cpu time   1292.1209: real time   1297.4266
    CORREC:  cpu time      0.0063: real time      0.0063
    CHARGE:  cpu time      0.2424: real time      0.2434
    --------------------------------------------
      LOOP:  cpu time   1293.5452: real time   1298.8554

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.2374017E-04  (-0.1578931E-04)
 number of electron      12.0000000 magnetization      -0.0000004
 augmentation part       -0.0019142 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -508.04601367
  -exchange      EXHF   =        26.47847457
  -V(xc)+E(xc)   XCENC  =       -66.89551568
  PAW double counting   =     81986.95746444   -81906.19384058
  entropy T*S    EENTRO =         0.00032368
  eigenvalues    EBANDS =       -34.80958871
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94943536 eV

  energy without entropy =      -10.94975904  energy(sigma->0) =      -10.94954326
  exchange ACFDT corr.  =        -0.00054835  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(  12)  ---------------------------------------


    POTLOK:  cpu time      0.3861: real time      0.3875
    SETDIJ:  cpu time      0.7898: real time      0.7919
    TRIAL :  cpu time   1290.0260: real time   1295.3142
    CORREC:  cpu time      0.0066: real time      0.0066
    CHARGE:  cpu time      0.2429: real time      0.2439
    --------------------------------------------
      LOOP:  cpu time   1291.4518: real time   1296.7446

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1222650E-04  (-0.8495029E-05)
 number of electron      12.0000000 magnetization      -0.0000004
 augmentation part       -0.0019073 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -508.03717582
  -exchange      EXHF   =        26.47831951
  -V(xc)+E(xc)   XCENC  =       -66.89557013
  PAW double counting   =     82001.99572276   -81921.23208045
  entropy T*S    EENTRO =         0.00032207
  eigenvalues    EBANDS =       -34.81824592
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94944759 eV

  energy without entropy =      -10.94976966  energy(sigma->0) =      -10.94955495
  exchange ACFDT corr.  =        -0.00054905  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      3(  13)  ---------------------------------------


    POTLOK:  cpu time      0.3857: real time      0.3871
    SETDIJ:  cpu time      0.7901: real time      0.7922
    TRIAL :  cpu time   1292.3850: real time   1297.6880
    CORREC:  cpu time      0.0064: real time      0.0065
    EDDIAG:  cpu time   1293.3391: real time   1298.6458
    CHARGE:  cpu time      0.2428: real time      0.2438
    --------------------------------------------
      LOOP:  cpu time   2587.1495: real time   2597.7638

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.6771428E-05  (-0.4719313E-05)
 number of electron      12.0000000 magnetization      -0.0000003
 augmentation part       -0.0019023 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.64982562
  -Hartree energ DENC   =      -508.03203006
  -exchange      EXHF   =        26.47836002
  -V(xc)+E(xc)   XCENC  =       -66.89558141
  PAW double counting   =     82014.57512258   -81933.81150203
  entropy T*S    EENTRO =         0.00032033
  eigenvalues    EBANDS =       -34.82334206
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94945436 eV

  energy without entropy =      -10.94977469  energy(sigma->0) =      -10.94956114
  exchange ACFDT corr.  =        -0.00054976  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------


  average scaling for gradient   1.0283


 average (electrostatic) potential at core
  the test charge radii are     1.0406
  (the norm of the test charge is              1.0000)
       1 -70.4308       2 -70.3885       3 -70.3986       4 -70.4464
 
 
 
 E-fermi :   2.6318     XC(G=0):  -4.7785     alpha+bet : -8.1680

 Fermi energy:         2.6318439498

 spin component 1

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3674      1.00000
      2     -10.0167      1.00000
      3      -8.0346      1.00000
      4      -5.2259      1.00000
      5      -1.9159      1.00000
      6       2.0380      1.00011
      7       4.5159     -0.00000
      8       6.5234     -0.00000
      9       6.7154     -0.00000
     10      10.8422      0.00000
     11      10.8655      0.00000
     12      15.5359      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2924      1.00000
      2      -9.9415      1.00000
      3      -7.9588      1.00000
      4      -5.1485      1.00000
      5      -1.8398      1.00000
      6       2.1137      1.00076
      7       4.5803     -0.00000
      8       6.5861     -0.00000
      9       6.7767     -0.00000
     10      10.8896      0.00000
     11      10.9210      0.00000
     12      13.9330      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2924      1.00000
      2      -9.9415      1.00000
      3      -7.9588      1.00000
      4      -5.1485      1.00000
      5      -1.8398      1.00000
      6       2.1137      1.00076
      7       4.5803     -0.00000
      8       6.5861     -0.00000
      9       6.7767     -0.00000
     10      10.8896      0.00000
     11      10.9210      0.00000
     12      13.9330      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2924      1.00000
      2      -9.9415      1.00000
      3      -7.9588      1.00000
      4      -5.1485      1.00000
      5      -1.8398      1.00000
      6       2.1137      1.00076
      7       4.5803     -0.00000
      8       6.5861     -0.00000
      9       6.7767     -0.00000
     10      10.8896      0.00000
     11      10.9210      0.00000
     12      13.9330      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7157      1.00000
      3      -7.7316      1.00000
      4      -4.9166      1.00000
      5      -1.6119      1.00000
      6       2.3373      1.02880
      7       4.7720     -0.00000
      8       6.7726     -0.00000
      9       6.9584     -0.00000
     10      10.9745      0.00000
     11      11.0810      0.00000
     12      11.9665      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7157      1.00000
      3      -7.7316      1.00000
      4      -4.9166      1.00000
      5      -1.6119      1.00000
      6       2.3373      1.02880
      7       4.7720     -0.00000
      8       6.7726     -0.00000
      9       6.9584     -0.00000
     10      10.9745      0.00000
     11      11.0810      0.00000
     12      11.9665      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7157      1.00000
      3      -7.7316      1.00000
      4      -4.9166      1.00000
      5      -1.6119      1.00000
      6       2.3373      1.02880
      7       4.7720     -0.00000
      8       6.7726     -0.00000
      9       6.9584     -0.00000
     10      10.9745      0.00000
     11      11.0810      0.00000
     12      11.9665      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.3393      1.00000
      3      -7.3528      1.00000
      4      -4.5308      1.00000
      5      -1.2334      1.00000
      6       2.6994      0.23221
      7       5.0865     -0.00000
      8       7.0726     -0.00000
      9       7.2475     -0.00000
     10       9.7571      0.00000
     11      10.6821      0.00000
     12      12.3601      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.3393      1.00000
      3      -7.3528      1.00000
      4      -4.5308      1.00000
      5      -1.2334      1.00000
      6       2.6994      0.23221
      7       5.0865     -0.00000
      8       7.0726     -0.00000
      9       7.2475     -0.00000
     10       9.7571      0.00000
     11      10.6821      0.00000
     12      12.0021      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.3393      1.00000
      3      -7.3528      1.00000
      4      -4.5308      1.00000
      5      -1.2334      1.00000
      6       2.6994      0.23221
      7       5.0865     -0.00000
      8       7.0726     -0.00000
      9       7.2475     -0.00000
     10       9.7571      0.00000
     11      10.6821      0.00000
     12      11.8602      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1671      1.00000
      2      -8.8120      1.00000
      3      -6.8224      1.00000
      4      -3.9921      1.00000
      5      -0.7066      1.00000
      6       3.1823     -0.00035
      7       5.5042     -0.00000
      8       7.2082     -0.00000
      9       7.5866     -0.00000
     10       8.1085      0.00000
     11       8.7543      0.00000
     12      10.4285      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1671      1.00000
      2      -8.8120      1.00000
      3      -6.8224      1.00000
      4      -3.9921      1.00000
      5      -0.7066      1.00000
      6       3.1823     -0.00035
      7       5.5042     -0.00000
      8       7.2082     -0.00000
      9       7.5866     -0.00000
     10       8.1085      0.00000
     11       8.7543      0.00000
     12      10.4285      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1671      1.00000
      2      -8.8120      1.00000
      3      -6.8224      1.00000
      4      -3.9921      1.00000
      5      -0.7066      1.00000
      6       3.1823     -0.00035
      7       5.5042     -0.00000
      8       7.2082     -0.00000
      9       7.5866     -0.00000
     10       8.1085      0.00000
     11       8.7543      0.00000
     12      10.4285      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4912      1.00000
      2      -8.1334      1.00000
      3      -6.1403      1.00000
      4      -3.3023      1.00000
      5      -0.0375      1.00000
      6       3.7222     -0.00000
      7       5.3966     -0.00000
      8       6.2540     -0.00000
      9       6.7400     -0.00000
     10       8.1014      0.00000
     11       8.2426      0.00000
     12       8.6140      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4912      1.00000
      2      -8.1334      1.00000
      3      -6.1403      1.00000
      4      -3.3023      1.00000
      5      -0.0375      1.00000
      6       3.7222     -0.00000
      7       5.3966     -0.00000
      8       6.2540     -0.00000
      9       6.7400     -0.00000
     10       8.1014      0.00000
     11       8.2426      0.00000
     12       8.6140      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4912      1.00000
      2      -8.1334      1.00000
      3      -6.1403      1.00000
      4      -3.3023      1.00000
      5      -0.0375      1.00000
      6       3.7222     -0.00000
      7       5.3966     -0.00000
      8       6.2540     -0.00000
      9       6.7400     -0.00000
     10       8.1014      0.00000
     11       8.2426      0.00000
     12       8.6140      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6643      1.00000
      2      -7.3030      1.00000
      3      -5.3063      1.00000
      4      -2.4665      1.00000
      5       0.7477      1.00000
      6       3.2544     -0.00005
      7       4.5106     -0.00000
      8       5.0316     -0.00000
      9       6.4635     -0.00000
     10       6.9478     -0.00000
     11       8.7949      0.00000
     12      10.6223      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6643      1.00000
      2      -7.3030      1.00000
      3      -5.3063      1.00000
      4      -2.4665      1.00000
      5       0.7477      1.00000
      6       3.2544     -0.00005
      7       4.5106     -0.00000
      8       5.0316     -0.00000
      9       6.4635     -0.00000
     10       6.9478     -0.00000
     11       8.7947      0.00000
     12      10.5706      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6643      1.00000
      2      -7.3030      1.00000
      3      -5.3063      1.00000
      4      -2.4665      1.00000
      5       0.7477      1.00000
      6       3.2544     -0.00005
      7       4.5106     -0.00000
      8       5.0316     -0.00000
      9       6.4635     -0.00000
     10       6.9478     -0.00000
     11       8.7950      0.00000
     12      10.6826      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6854      1.00000
      2      -6.3202      1.00000
      3      -4.3221      1.00000
      4      -1.5042      1.00000
      5       1.1148      1.00000
      6       1.9690      1.00002
      7       2.9071     -0.03255
      8       4.6977     -0.00000
      9       5.5684     -0.00000
     10       7.2785     -0.00000
     11       7.6762     -0.00000
     12      10.2773      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6854      1.00000
      2      -6.3202      1.00000
      3      -4.3221      1.00000
      4      -1.5042      1.00000
      5       1.1148      1.00000
      6       1.9690      1.00002
      7       2.9071     -0.03255
      8       4.6977     -0.00000
      9       5.5684     -0.00000
     10       7.2785     -0.00000
     11       7.6762     -0.00000
     12      10.2784      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6854      1.00000
      2      -6.3202      1.00000
      3      -4.3221      1.00000
      4      -1.5042      1.00000
      5       1.1148      1.00000
      6       1.9690      1.00002
      7       2.9071     -0.03255
      8       4.6977     -0.00000
      9       5.5684     -0.00000
     10       7.2785     -0.00000
     11       7.6762     -0.00000
     12      10.2788      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5537      1.00000
      2      -5.1852      1.00000
      3      -3.1947      1.00000
      4      -0.7650      1.00000
      5      -0.2271      1.00000
      6       1.0662      1.00000
      7       2.8551     -0.03342
      8       3.0994     -0.00229
      9       5.5780     -0.00000
     10       6.5512     -0.00000
     11       8.3026      0.00000
     12       9.9164      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5537      1.00000
      2      -5.1852      1.00000
      3      -3.1947      1.00000
      4      -0.7650      1.00000
      5      -0.2271      1.00000
      6       1.0662      1.00000
      7       2.8551     -0.03342
      8       3.0994     -0.00229
      9       5.5780     -0.00000
     10       6.5512     -0.00000
     11       8.3026      0.00000
     12       9.9137      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5537      1.00000
      2      -5.1852      1.00000
      3      -3.1947      1.00000
      4      -0.7650      1.00000
      5      -0.2271      1.00000
      6       1.0662      1.00000
      7       2.8551     -0.03342
      8       3.0994     -0.00229
      9       5.5780     -0.00000
     10       6.5512     -0.00000
     11       8.3026      0.00000
     12       9.8668      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2690      1.00000
      2      -3.9022      1.00000
      3      -2.2632      1.00000
      4      -1.9807      1.00000
      5      -0.8666      1.00000
      6       0.9084      1.00000
      7       1.5237      1.00000
      8       4.0029     -0.00000
      9       4.1907     -0.00000
     10       6.8814     -0.00000
     11       7.6009     -0.00000
     12       9.8008      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2690      1.00000
      2      -3.9022      1.00000
      3      -2.2632      1.00000
      4      -1.9807      1.00000
      5      -0.8666      1.00000
      6       0.9084      1.00000
      7       1.5237      1.00000
      8       4.0029     -0.00000
      9       4.1907     -0.00000
     10       6.8814     -0.00000
     11       7.6009     -0.00000
     12       9.8008      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2690      1.00000
      2      -3.9022      1.00000
      3      -2.2632      1.00000
      4      -1.9807      1.00000
      5      -0.8666      1.00000
      6       0.9084      1.00000
      7       1.5237      1.00000
      8       4.0029     -0.00000
      9       4.1907     -0.00000
     10       6.8814     -0.00000
     11       7.6009     -0.00000
     12       9.8008      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8578      1.00000
      2      -3.8101      1.00000
      3      -2.5299      1.00000
      4      -2.4585      1.00000
      5      -0.8059      1.00000
      6       0.0368      1.00000
      7       2.3625      1.03354
      8       2.7227      0.15411
      9       5.2677     -0.00000
     10       5.7027     -0.00000
     11       8.4677      0.00000
     12       9.1939      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8578      1.00000
      2      -3.8101      1.00000
      3      -2.5299      1.00000
      4      -2.4585      1.00000
      5      -0.8059      1.00000
      6       0.0368      1.00000
      7       2.3625      1.03354
      8       2.7227      0.15411
      9       5.2677     -0.00000
     10       5.7027     -0.00000
     11       8.4677      0.00000
     12       9.6788      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8578      1.00000
      2      -3.8101      1.00000
      3      -2.5299      1.00000
      4      -2.4585      1.00000
      5      -0.8059      1.00000
      6       0.0368      1.00000
      7       2.3625      1.03354
      8       2.7227      0.15411
      9       5.2677     -0.00000
     10       5.7027     -0.00000
     11       8.4677      0.00000
     12       9.6780      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1424      1.00000
      2      -9.7910      1.00000
      3      -7.8073      1.00000
      4      -4.9938      1.00000
      5      -1.6878      1.00000
      6       2.2633      1.01280
      7       4.7083     -0.00000
      8       6.7108     -0.00000
      9       6.8983     -0.00000
     10      10.9718      0.00000
     11      11.0260      0.00000
     12      12.9523      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1424      1.00000
      2      -9.7910      1.00000
      3      -7.8073      1.00000
      4      -4.9938      1.00000
      5      -1.6878      1.00000
      6       2.2633      1.01280
      7       4.7083     -0.00000
      8       6.7108     -0.00000
      9       6.8983     -0.00000
     10      10.9718      0.00000
     11      11.0260      0.00000
     12      12.9372      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1424      1.00000
      2      -9.7910      1.00000
      3      -7.8073      1.00000
      4      -4.9938      1.00000
      5      -1.6878      1.00000
      6       2.2633      1.01280
      7       4.7083     -0.00000
      8       6.7108     -0.00000
      9       6.8983     -0.00000
     10      10.9719      0.00000
     11      11.0260      0.00000
     12      12.9384      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79670
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1819      0.00000
     12      11.4961      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79670
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1819      0.00000
     12      11.4960      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79670
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1819      0.00000
     12      11.4961      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79670
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1819      0.00000
     12      11.4961      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79670
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1819      0.00000
     12      11.4960      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79670
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1819      0.00000
     12      11.4961      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
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      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4376      0.00000
     12       9.2054      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4376      0.00000
     12       9.2052      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4376      0.00000
     12       9.2053      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4376      0.00000
     12       9.2052      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4376      0.00000
     12       9.2055      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4376      0.00000
     12       9.2055      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4673      1.00000
      2      -9.1133      1.00000
      3      -7.1255      1.00000
      4      -4.2997      1.00000
      5      -1.0070      1.00000
      6       2.9111     -0.03193
      7       5.2727     -0.00000
      8       7.2506     -0.00000
      9       7.4121     -0.00000
     10       9.9082      0.00000
     11       9.9307      0.00000
     12      10.8586      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4673      1.00000
      2      -9.1133      1.00000
      3      -7.1255      1.00000
      4      -4.2997      1.00000
      5      -1.0070      1.00000
      6       2.9111     -0.03193
      7       5.2727     -0.00000
      8       7.2506     -0.00000
      9       7.4121     -0.00000
     10       9.9081      0.00000
     11       9.9308      0.00000
     12      10.8707      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4673      1.00000
      2      -9.1133      1.00000
      3      -7.1255      1.00000
      4      -4.2997      1.00000
      5      -1.0070      1.00000
      6       2.9111     -0.03193
      7       5.2727     -0.00000
      8       7.2506     -0.00000
      9       7.4121     -0.00000
     10       9.9079      0.00000
     11       9.9311      0.00000
     12      10.8936      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2132      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2132      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2132      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2132      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2132      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2132      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9213     -0.00000
     10       7.9909     -0.00000
     11       8.4377      0.00000
     12       8.5582      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9213     -0.00000
     10       7.9909     -0.00000
     11       8.4377      0.00000
     12       8.5582      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9213     -0.00000
     10       7.9909     -0.00000
     11       8.4377      0.00000
     12       8.5582      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9213     -0.00000
     10       7.9909     -0.00000
     11       8.4377      0.00000
     12       8.5582      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9213     -0.00000
     10       7.9909     -0.00000
     11       8.4377      0.00000
     12       8.5582      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9213     -0.00000
     10       7.9909     -0.00000
     11       8.4377      0.00000
     12       8.5582      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3367      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3367      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3367      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3367      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3367      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3367      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2995      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2995      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2995      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2995      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2995      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2995      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6315      1.00000
      2      -3.5814      1.00000
      3      -2.3022      1.00000
      4      -2.2374      1.00000
      5      -0.5896      1.00000
      6       0.2623      1.00000
      7       2.5594      0.78495
      8       2.9090     -0.03217
      9       5.3771     -0.00000
     10       5.8832     -0.00000
     11       6.6863     -0.00000
     12       7.9001     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6315      1.00000
      2      -3.5814      1.00000
      3      -2.3022      1.00000
      4      -2.2374      1.00000
      5      -0.5896      1.00000
      6       0.2623      1.00000
      7       2.5594      0.78495
      8       2.9090     -0.03217
      9       5.3771     -0.00000
     10       5.8832     -0.00000
     11       6.6863     -0.00000
     12       7.9001     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6315      1.00000
      2      -3.5814      1.00000
      3      -2.3022      1.00000
      4      -2.2374      1.00000
      5      -0.5896      1.00000
      6       0.2623      1.00000
      7       2.5594      0.78495
      8       2.9090     -0.03217
      9       5.3771     -0.00000
     10       5.8832     -0.00000
     11       6.6863     -0.00000
     12       7.9001     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3409      1.00000
      2      -7.9826      1.00000
      3      -5.9887      1.00000
      4      -3.1494      1.00000
      5       0.1127      1.00000
      6       3.8864     -0.00000
      7       6.0319     -0.00000
      8       6.9674     -0.00000
      9       7.0149     -0.00000
     10       8.0578     -0.00000
     11       8.1530      0.00000
     12       8.4148      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3409      1.00000
      2      -7.9826      1.00000
      3      -5.9887      1.00000
      4      -3.1494      1.00000
      5       0.1127      1.00000
      6       3.8864     -0.00000
      7       6.0319     -0.00000
      8       6.9674     -0.00000
      9       7.0149     -0.00000
     10       8.0578     -0.00000
     11       8.1530      0.00000
     12       8.4148      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3409      1.00000
      2      -7.9826      1.00000
      3      -5.9887      1.00000
      4      -3.1494      1.00000
      5       0.1127      1.00000
      6       3.8864     -0.00000
      7       6.0319     -0.00000
      8       6.9674     -0.00000
      9       7.0149     -0.00000
     10       8.0578     -0.00000
     11       8.1530      0.00000
     12       8.4149      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6773     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6773     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6773     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6773     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6773     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6773     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7606      1.00000
      2      -6.3961      1.00000
      3      -4.3975      1.00000
      4      -1.5644      1.00000
      5       1.5909      1.00000
      6       3.9923     -0.00000
      7       4.2248     -0.00000
      8       5.2782     -0.00000
      9       5.4951     -0.00000
     10       6.0228     -0.00000
     11       7.0961     -0.00000
     12       7.4119     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7606      1.00000
      2      -6.3961      1.00000
      3      -4.3975      1.00000
      4      -1.5644      1.00000
      5       1.5909      1.00000
      6       3.9923     -0.00000
      7       4.2248     -0.00000
      8       5.2782     -0.00000
      9       5.4951     -0.00000
     10       6.0228     -0.00000
     11       7.0961     -0.00000
     12       7.4119     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7606      1.00000
      2      -6.3961      1.00000
      3      -4.3975      1.00000
      4      -1.5644      1.00000
      5       1.5909      1.00000
      6       3.9923     -0.00000
      7       4.2248     -0.00000
      8       5.2782     -0.00000
      9       5.4951     -0.00000
     10       6.0228     -0.00000
     11       7.0961     -0.00000
     12       7.4119     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9538      1.00000
      2      -2.8968      1.00000
      3      -1.6225      1.00000
      4      -1.5753      1.00000
      5       0.0525      1.00000
      6       0.9193      1.00000
      7       2.7063      0.20702
      8       2.9525     -0.02287
      9       3.8808     -0.00000
     10       4.7776     -0.00000
     11       6.1611     -0.00000
     12       6.4760     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9538      1.00000
      2      -2.8968      1.00000
      3      -1.6225      1.00000
      4      -1.5753      1.00000
      5       0.0525      1.00000
      6       0.9193      1.00000
      7       2.7063      0.20702
      8       2.9525     -0.02287
      9       3.8808     -0.00000
     10       4.7776     -0.00000
     11       6.1611     -0.00000
     12       6.4760     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9538      1.00000
      2      -2.8968      1.00000
      3      -1.6225      1.00000
      4      -1.5753      1.00000
      5       0.0525      1.00000
      6       0.9193      1.00000
      7       2.7063      0.20702
      8       2.9525     -0.02287
      9       3.8808     -0.00000
     10       4.7776     -0.00000
     11       6.1610     -0.00000
     12       6.4760     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3532      1.00000
      3      -2.3682      1.00000
      4       0.3010      1.00000
      5       1.6006      1.00000
      6       1.9015      1.00000
      7       3.0099     -0.01108
      8       3.2935     -0.00001
      9       4.0219     -0.00000
     10       4.8034     -0.00000
     11       5.6228     -0.00000
     12       7.2689     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3532      1.00000
      3      -2.3682      1.00000
      4       0.3010      1.00000
      5       1.6006      1.00000
      6       1.9015      1.00000
      7       3.0099     -0.01108
      8       3.2935     -0.00001
      9       4.0219     -0.00000
     10       4.8034     -0.00000
     11       5.6228     -0.00000
     12       7.2689     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3532      1.00000
      3      -2.3682      1.00000
      4       0.3010      1.00000
      5       1.6006      1.00000
      6       1.9015      1.00000
      7       3.0099     -0.01108
      8       3.2935     -0.00001
      9       4.0219     -0.00000
     10       4.8034     -0.00000
     11       5.6228     -0.00000
     12       7.2689     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7526      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7526      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7527      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7527      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7526      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7526      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8764      1.00000
      3      -0.2759      1.00000
      4      -0.2148      1.00000
      5      -0.0647      1.00000
      6       0.9359      1.00000
      7       1.2655      1.00000
      8       2.4772      0.98170
      9       3.6849     -0.00000
     10       3.8186     -0.00000
     11       5.9765     -0.00000
     12       6.2160     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8764      1.00000
      3      -0.2759      1.00000
      4      -0.2148      1.00000
      5      -0.0647      1.00000
      6       0.9359      1.00000
      7       1.2655      1.00000
      8       2.4772      0.98170
      9       3.6849     -0.00000
     10       3.8186     -0.00000
     11       5.9761     -0.00000
     12       6.2184     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8764      1.00000
      3      -0.2759      1.00000
      4      -0.2148      1.00000
      5      -0.0647      1.00000
      6       0.9359      1.00000
      7       1.2655      1.00000
      8       2.4772      0.98170
      9       3.6849     -0.00000
     10       3.8186     -0.00000
     11       5.9770     -0.00000
     12       6.2144     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8300      1.00000
      2      -1.7636      1.00000
      3      -0.5148      1.00000
      4      -0.4887      1.00000
      5      -0.3052      1.00000
      6       0.7178      1.00000
      7       1.4326      1.00000
      8       1.7846      1.00000
      9       3.4589     -0.00000
     10       4.5822     -0.00000
     11       4.8566     -0.00000
     12       6.0305     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8300      1.00000
      2      -1.7636      1.00000
      3      -0.5148      1.00000
      4      -0.4887      1.00000
      5      -0.3052      1.00000
      6       0.7178      1.00000
      7       1.4326      1.00000
      8       1.7846      1.00000
      9       3.4589     -0.00000
     10       4.5822     -0.00000
     11       4.8566     -0.00000
     12       6.0305     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8300      1.00000
      2      -1.7636      1.00000
      3      -0.5148      1.00000
      4      -0.4887      1.00000
      5      -0.3052      1.00000
      6       0.7178      1.00000
      7       1.4326      1.00000
      8       1.7846      1.00000
      9       3.4589     -0.00000
     10       4.5822     -0.00000
     11       4.8566     -0.00000
     12       6.0305     -0.00000
 Fermi energy:         2.6318439498

 spin component 2

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3674      1.00000
      2     -10.0167      1.00000
      3      -8.0346      1.00000
      4      -5.2259      1.00000
      5      -1.9159      1.00000
      6       2.0380      1.00011
      7       4.5159     -0.00000
      8       6.5234     -0.00000
      9       6.7154     -0.00000
     10      10.8422      0.00000
     11      10.8655      0.00000
     12      15.5316      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2924      1.00000
      2      -9.9415      1.00000
      3      -7.9588      1.00000
      4      -5.1485      1.00000
      5      -1.8398      1.00000
      6       2.1137      1.00076
      7       4.5803     -0.00000
      8       6.5861     -0.00000
      9       6.7767     -0.00000
     10      10.8896      0.00000
     11      10.9210      0.00000
     12      13.9330      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2924      1.00000
      2      -9.9415      1.00000
      3      -7.9588      1.00000
      4      -5.1485      1.00000
      5      -1.8398      1.00000
      6       2.1137      1.00076
      7       4.5803     -0.00000
      8       6.5861     -0.00000
      9       6.7767     -0.00000
     10      10.8896      0.00000
     11      10.9210      0.00000
     12      13.9330      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2924      1.00000
      2      -9.9415      1.00000
      3      -7.9588      1.00000
      4      -5.1485      1.00000
      5      -1.8398      1.00000
      6       2.1137      1.00076
      7       4.5803     -0.00000
      8       6.5861     -0.00000
      9       6.7767     -0.00000
     10      10.8896      0.00000
     11      10.9210      0.00000
     12      13.9330      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7157      1.00000
      3      -7.7316      1.00000
      4      -4.9166      1.00000
      5      -1.6119      1.00000
      6       2.3373      1.02880
      7       4.7720     -0.00000
      8       6.7726     -0.00000
      9       6.9584     -0.00000
     10      10.9745      0.00000
     11      11.0810      0.00000
     12      11.9665      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7157      1.00000
      3      -7.7316      1.00000
      4      -4.9166      1.00000
      5      -1.6119      1.00000
      6       2.3373      1.02880
      7       4.7720     -0.00000
      8       6.7726     -0.00000
      9       6.9584     -0.00000
     10      10.9745      0.00000
     11      11.0810      0.00000
     12      11.9665      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0675      1.00000
      2      -9.7157      1.00000
      3      -7.7316      1.00000
      4      -4.9166      1.00000
      5      -1.6119      1.00000
      6       2.3373      1.02880
      7       4.7720     -0.00000
      8       6.7726     -0.00000
      9       6.9584     -0.00000
     10      10.9745      0.00000
     11      11.0810      0.00000
     12      11.9665      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.3393      1.00000
      3      -7.3528      1.00000
      4      -4.5308      1.00000
      5      -1.2334      1.00000
      6       2.6994      0.23222
      7       5.0865     -0.00000
      8       7.0726     -0.00000
      9       7.2475     -0.00000
     10       9.7571      0.00000
     11      10.6821      0.00000
     12      11.8970      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.3393      1.00000
      3      -7.3528      1.00000
      4      -4.5308      1.00000
      5      -1.2334      1.00000
      6       2.6994      0.23222
      7       5.0865     -0.00000
      8       7.0726     -0.00000
      9       7.2475     -0.00000
     10       9.7571      0.00000
     11      10.6821      0.00000
     12      11.7254      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6924      1.00000
      2      -9.3393      1.00000
      3      -7.3528      1.00000
      4      -4.5308      1.00000
      5      -1.2334      1.00000
      6       2.6994      0.23222
      7       5.0865     -0.00000
      8       7.0726     -0.00000
      9       7.2475     -0.00000
     10       9.7571      0.00000
     11      10.6821      0.00000
     12      12.2776      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1671      1.00000
      2      -8.8120      1.00000
      3      -6.8224      1.00000
      4      -3.9921      1.00000
      5      -0.7066      1.00000
      6       3.1823     -0.00035
      7       5.5042     -0.00000
      8       7.2082     -0.00000
      9       7.5866     -0.00000
     10       8.1085      0.00000
     11       8.7543      0.00000
     12      10.4285      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1671      1.00000
      2      -8.8120      1.00000
      3      -6.8224      1.00000
      4      -3.9921      1.00000
      5      -0.7066      1.00000
      6       3.1823     -0.00035
      7       5.5042     -0.00000
      8       7.2082     -0.00000
      9       7.5866     -0.00000
     10       8.1085      0.00000
     11       8.7543      0.00000
     12      10.4285      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1671      1.00000
      2      -8.8120      1.00000
      3      -6.8224      1.00000
      4      -3.9921      1.00000
      5      -0.7066      1.00000
      6       3.1823     -0.00035
      7       5.5042     -0.00000
      8       7.2082     -0.00000
      9       7.5866     -0.00000
     10       8.1085      0.00000
     11       8.7543      0.00000
     12      10.4285      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4912      1.00000
      2      -8.1334      1.00000
      3      -6.1403      1.00000
      4      -3.3023      1.00000
      5      -0.0375      1.00000
      6       3.7222     -0.00000
      7       5.3966     -0.00000
      8       6.2540     -0.00000
      9       6.7400     -0.00000
     10       8.1014      0.00000
     11       8.2426      0.00000
     12       8.6140      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4912      1.00000
      2      -8.1334      1.00000
      3      -6.1403      1.00000
      4      -3.3023      1.00000
      5      -0.0375      1.00000
      6       3.7222     -0.00000
      7       5.3966     -0.00000
      8       6.2540     -0.00000
      9       6.7400     -0.00000
     10       8.1014      0.00000
     11       8.2426      0.00000
     12       8.6140      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4912      1.00000
      2      -8.1334      1.00000
      3      -6.1403      1.00000
      4      -3.3023      1.00000
      5      -0.0375      1.00000
      6       3.7222     -0.00000
      7       5.3966     -0.00000
      8       6.2540     -0.00000
      9       6.7400     -0.00000
     10       8.1014      0.00000
     11       8.2426      0.00000
     12       8.6140      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6643      1.00000
      2      -7.3030      1.00000
      3      -5.3063      1.00000
      4      -2.4665      1.00000
      5       0.7477      1.00000
      6       3.2544     -0.00005
      7       4.5106     -0.00000
      8       5.0316     -0.00000
      9       6.4635     -0.00000
     10       6.9478     -0.00000
     11       8.7871      0.00000
     12       9.7334      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6643      1.00000
      2      -7.3030      1.00000
      3      -5.3063      1.00000
      4      -2.4665      1.00000
      5       0.7477      1.00000
      6       3.2544     -0.00005
      7       4.5106     -0.00000
      8       5.0316     -0.00000
      9       6.4635     -0.00000
     10       6.9478     -0.00000
     11       8.7942      0.00000
     12      10.3081      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6643      1.00000
      2      -7.3030      1.00000
      3      -5.3063      1.00000
      4      -2.4665      1.00000
      5       0.7477      1.00000
      6       3.2544     -0.00005
      7       4.5106     -0.00000
      8       5.0316     -0.00000
      9       6.4635     -0.00000
     10       6.9478     -0.00000
     11       8.7924      0.00000
     12       9.9586      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6854      1.00000
      2      -6.3202      1.00000
      3      -4.3221      1.00000
      4      -1.5042      1.00000
      5       1.1148      1.00000
      6       1.9690      1.00002
      7       2.9071     -0.03255
      8       4.6977     -0.00000
      9       5.5684     -0.00000
     10       7.2785     -0.00000
     11       7.6762     -0.00000
     12      10.2740      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6854      1.00000
      2      -6.3202      1.00000
      3      -4.3221      1.00000
      4      -1.5042      1.00000
      5       1.1148      1.00000
      6       1.9690      1.00002
      7       2.9071     -0.03255
      8       4.6977     -0.00000
      9       5.5684     -0.00000
     10       7.2785     -0.00000
     11       7.6762     -0.00000
     12      10.2786      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6854      1.00000
      2      -6.3202      1.00000
      3      -4.3221      1.00000
      4      -1.5042      1.00000
      5       1.1148      1.00000
      6       1.9690      1.00002
      7       2.9071     -0.03255
      8       4.6977     -0.00000
      9       5.5684     -0.00000
     10       7.2785     -0.00000
     11       7.6762     -0.00000
     12      10.2788      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5537      1.00000
      2      -5.1852      1.00000
      3      -3.1947      1.00000
      4      -0.7650      1.00000
      5      -0.2271      1.00000
      6       1.0662      1.00000
      7       2.8551     -0.03342
      8       3.0994     -0.00229
      9       5.5780     -0.00000
     10       6.5512     -0.00000
     11       8.3026      0.00000
     12       9.7499      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5537      1.00000
      2      -5.1852      1.00000
      3      -3.1947      1.00000
      4      -0.7650      1.00000
      5      -0.2271      1.00000
      6       1.0662      1.00000
      7       2.8551     -0.03342
      8       3.0994     -0.00229
      9       5.5780     -0.00000
     10       6.5512     -0.00000
     11       8.3026      0.00000
     12       9.8381      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5537      1.00000
      2      -5.1852      1.00000
      3      -3.1947      1.00000
      4      -0.7650      1.00000
      5      -0.2271      1.00000
      6       1.0662      1.00000
      7       2.8551     -0.03342
      8       3.0994     -0.00229
      9       5.5780     -0.00000
     10       6.5512     -0.00000
     11       8.3026      0.00000
     12       9.8388      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2690      1.00000
      2      -3.9022      1.00000
      3      -2.2632      1.00000
      4      -1.9807      1.00000
      5      -0.8666      1.00000
      6       0.9084      1.00000
      7       1.5237      1.00000
      8       4.0029     -0.00000
      9       4.1907     -0.00000
     10       6.8814     -0.00000
     11       7.6009     -0.00000
     12       9.8008      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2690      1.00000
      2      -3.9022      1.00000
      3      -2.2632      1.00000
      4      -1.9807      1.00000
      5      -0.8666      1.00000
      6       0.9084      1.00000
      7       1.5237      1.00000
      8       4.0029     -0.00000
      9       4.1907     -0.00000
     10       6.8814     -0.00000
     11       7.6009     -0.00000
     12       9.8008      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2690      1.00000
      2      -3.9022      1.00000
      3      -2.2632      1.00000
      4      -1.9807      1.00000
      5      -0.8666      1.00000
      6       0.9084      1.00000
      7       1.5237      1.00000
      8       4.0029     -0.00000
      9       4.1907     -0.00000
     10       6.8814     -0.00000
     11       7.6009     -0.00000
     12       9.8008      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8578      1.00000
      2      -3.8101      1.00000
      3      -2.5299      1.00000
      4      -2.4585      1.00000
      5      -0.8059      1.00000
      6       0.0368      1.00000
      7       2.3625      1.03354
      8       2.7227      0.15411
      9       5.2677     -0.00000
     10       5.7027     -0.00000
     11       8.4677      0.00000
     12       9.4831      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8578      1.00000
      2      -3.8101      1.00000
      3      -2.5299      1.00000
      4      -2.4585      1.00000
      5      -0.8059      1.00000
      6       0.0368      1.00000
      7       2.3625      1.03354
      8       2.7227      0.15411
      9       5.2677     -0.00000
     10       5.7027     -0.00000
     11       8.4677      0.00000
     12       9.7098      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8578      1.00000
      2      -3.8101      1.00000
      3      -2.5299      1.00000
      4      -2.4585      1.00000
      5      -0.8059      1.00000
      6       0.0368      1.00000
      7       2.3625      1.03354
      8       2.7227      0.15411
      9       5.2677     -0.00000
     10       5.7027     -0.00000
     11       8.4677      0.00000
     12       9.0359      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1424      1.00000
      2      -9.7910      1.00000
      3      -7.8073      1.00000
      4      -4.9938      1.00000
      5      -1.6878      1.00000
      6       2.2633      1.01280
      7       4.7083     -0.00000
      8       6.7108     -0.00000
      9       6.8983     -0.00000
     10      10.9718      0.00000
     11      11.0260      0.00000
     12      12.9342      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1424      1.00000
      2      -9.7910      1.00000
      3      -7.8073      1.00000
      4      -4.9938      1.00000
      5      -1.6878      1.00000
      6       2.2633      1.01280
      7       4.7083     -0.00000
      8       6.7108     -0.00000
      9       6.8983     -0.00000
     10      10.9718      0.00000
     11      11.0260      0.00000
     12      12.9354      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1424      1.00000
      2      -9.7910      1.00000
      3      -7.8073      1.00000
      4      -4.9938      1.00000
      5      -1.6878      1.00000
      6       2.2633      1.01280
      7       4.7083     -0.00000
      8       6.7108     -0.00000
      9       6.8983     -0.00000
     10      10.9718      0.00000
     11      11.0260      0.00000
     12      12.9422      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79671
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1769      0.00000
     12      11.4546      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79671
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1769      0.00000
     12      11.4546      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79671
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1769      0.00000
     12      11.4546      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79671
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1769      0.00000
     12      11.4546      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79671
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1769      0.00000
     12      11.4546      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8424      1.00000
      2      -9.4898      1.00000
      3      -7.5043      1.00000
      4      -4.6850      1.00000
      5      -1.3846      1.00000
      6       2.5562      0.79671
      7       4.9617     -0.00000
      8       6.9559     -0.00000
      9       7.1354     -0.00000
     10      10.7075      0.00000
     11      11.1769      0.00000
     12      11.4546      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3922      1.00000
      2      -9.0380      1.00000
      3      -7.0498      1.00000
      4      -4.2227      1.00000
      5      -0.9318      1.00000
      6       2.9798     -0.01688
      7       5.3321     -0.00000
      8       7.2864     -0.00000
      9       7.4552     -0.00000
     10       8.8484      0.00000
     11       9.7838      0.00000
     12      11.0464      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7917      1.00000
      2      -8.4351      1.00000
      3      -6.4435      1.00000
      4      -3.6084      1.00000
      5      -0.3330      1.00000
      6       3.5063     -0.00000
      7       5.7396     -0.00000
      8       6.6185     -0.00000
      9       7.7182     -0.00000
     10       7.9016     -0.00000
     11       8.1622      0.00000
     12       9.4930      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4377      0.00000
     12       9.1607      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4377      0.00000
     12       9.1611      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4377      0.00000
     12       9.1591      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4377      0.00000
     12       9.1593      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4377      0.00000
     12       9.1607      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0403      1.00000
      2      -7.6806      1.00000
      3      -5.6854      1.00000
      4      -2.8449      1.00000
      5       0.4000      1.00000
      6       3.8667     -0.00000
      7       4.7798     -0.00000
      8       5.8271     -0.00000
      9       6.5297     -0.00000
     10       7.5528     -0.00000
     11       8.4377      0.00000
     12       9.1572      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1374      1.00000
      2      -6.7740      1.00000
      3      -4.7760      1.00000
      4      -1.9418      1.00000
      5       1.1825      1.00000
      6       2.4884      0.96503
      7       3.8135     -0.00000
      8       5.2040     -0.00000
      9       5.6622     -0.00000
     10       7.2919     -0.00000
     11       8.1321      0.00000
     12       8.9431      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0821      1.00000
      2      -5.7149      1.00000
      3      -3.7187      1.00000
      4      -0.9537      1.00000
      5       0.4455      1.00000
      6       1.8381      1.00000
      7       2.6101      0.59108
      8       3.8717     -0.00000
      9       5.9857     -0.00000
     10       6.5421     -0.00000
     11       8.0932      0.00000
     12       8.7636      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8736      1.00000
      2      -4.5049      1.00000
      3      -2.5308      1.00000
      4      -1.3902      1.00000
      5      -0.2271      1.00000
      6       0.7455      1.00000
      7       2.1786      1.00311
      8       3.6179     -0.00000
      9       4.8416     -0.00000
     10       7.0343     -0.00000
     11       7.6517     -0.00000
     12       8.5432      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5132      1.00000
      2      -3.1542      1.00000
      3      -3.0061      1.00000
      4      -1.7709      1.00000
      5      -1.0816      1.00000
      6       0.5073      1.00000
      7       1.9119      1.00000
      8       3.3300     -0.00000
      9       4.8334     -0.00000
     10       6.2451     -0.00000
     11       7.9837     -0.00000
     12       8.4856      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4673      1.00000
      2      -9.1133      1.00000
      3      -7.1255      1.00000
      4      -4.2997      1.00000
      5      -1.0070      1.00000
      6       2.9111     -0.03193
      7       5.2727     -0.00000
      8       7.2506     -0.00000
      9       7.4121     -0.00000
     10       9.9082      0.00000
     11       9.9307      0.00000
     12      10.8587      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4673      1.00000
      2      -9.1133      1.00000
      3      -7.1255      1.00000
      4      -4.2997      1.00000
      5      -1.0070      1.00000
      6       2.9111     -0.03193
      7       5.2727     -0.00000
      8       7.2506     -0.00000
      9       7.4121     -0.00000
     10       9.9084      0.00000
     11       9.9306      0.00000
     12      10.8396      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4673      1.00000
      2      -9.1133      1.00000
      3      -7.1255      1.00000
      4      -4.2997      1.00000
      5      -1.0070      1.00000
      6       2.9111     -0.03193
      7       5.2727     -0.00000
      8       7.2506     -0.00000
      9       7.4121     -0.00000
     10       9.9083      0.00000
     11       9.9306      0.00000
     12      10.8419      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2131      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2131      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2131      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2131      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2131      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9418      1.00000
      2      -8.5859      1.00000
      3      -6.5951      1.00000
      4      -3.7617      1.00000
      5      -0.4816      1.00000
      6       3.3852     -0.00000
      7       5.6842     -0.00000
      8       7.4008     -0.00000
      9       7.6952     -0.00000
     10       8.2751      0.00000
     11       8.9027      0.00000
     12       9.2131      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9212     -0.00000
     10       7.9909     -0.00000
     11       8.4432      0.00000
     12       8.5631      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9212     -0.00000
     10       7.9909     -0.00000
     11       8.4432      0.00000
     12       8.5631      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9213     -0.00000
     10       7.9909     -0.00000
     11       8.4432      0.00000
     12       8.5631      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9213     -0.00000
     10       7.9909     -0.00000
     11       8.4432      0.00000
     12       8.5631      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9212     -0.00000
     10       7.9909     -0.00000
     11       8.4432      0.00000
     12       8.5631      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2658      1.00000
      2      -7.9071      1.00000
      3      -5.9129      1.00000
      4      -3.0731      1.00000
      5       0.1851      1.00000
      6       3.9167     -0.00000
      7       5.5860     -0.00000
      8       6.4249     -0.00000
      9       6.9212     -0.00000
     10       7.9909     -0.00000
     11       8.4432      0.00000
     12       8.5631      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4385      1.00000
      2      -7.0764      1.00000
      3      -5.0790      1.00000
      4      -2.2393      1.00000
      5       0.9664      1.00000
      6       3.4668     -0.00000
      7       4.7019     -0.00000
      8       5.1977     -0.00000
      9       6.6362     -0.00000
     10       7.0416     -0.00000
     11       7.7399     -0.00000
     12       8.7610      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3081      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3081      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3081      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3081      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3081      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4591      1.00000
      2      -6.0933      1.00000
      3      -4.0953      1.00000
      4      -1.2809      1.00000
      5       1.3330      1.00000
      6       2.1832      1.00341
      7       3.1166     -0.00161
      8       4.8882     -0.00000
      9       5.6673     -0.00000
     10       7.0840     -0.00000
     11       7.4751     -0.00000
     12       8.3081      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2994      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2994      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2994      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2994      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2994      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3268      1.00000
      2      -4.9583      1.00000
      3      -2.9694      1.00000
      4      -0.5463      1.00000
      5      -0.0041      1.00000
      6       1.2851      1.00000
      7       3.0538     -0.00550
      8       3.3043     -0.00001
      9       5.6604     -0.00000
     10       6.5014     -0.00000
     11       7.1611     -0.00000
     12       8.2994      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6758      1.00000
      3      -2.0368      1.00000
      4      -1.7591      1.00000
      5      -0.6444      1.00000
      6       1.1247      1.00000
      7       1.7322      1.00000
      8       4.1572     -0.00000
      9       4.3805     -0.00000
     10       6.5606     -0.00000
     11       7.0736     -0.00000
     12       7.8286     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6315      1.00000
      2      -3.5814      1.00000
      3      -2.3022      1.00000
      4      -2.2374      1.00000
      5      -0.5896      1.00000
      6       0.2623      1.00000
      7       2.5594      0.78495
      8       2.9090     -0.03217
      9       5.3771     -0.00000
     10       5.8832     -0.00000
     11       6.6863     -0.00000
     12       7.9001     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6315      1.00000
      2      -3.5814      1.00000
      3      -2.3022      1.00000
      4      -2.2374      1.00000
      5      -0.5896      1.00000
      6       0.2623      1.00000
      7       2.5594      0.78495
      8       2.9090     -0.03217
      9       5.3771     -0.00000
     10       5.8832     -0.00000
     11       6.6863     -0.00000
     12       7.9001     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6315      1.00000
      2      -3.5814      1.00000
      3      -2.3022      1.00000
      4      -2.2374      1.00000
      5      -0.5896      1.00000
      6       0.2623      1.00000
      7       2.5594      0.78495
      8       2.9090     -0.03217
      9       5.3771     -0.00000
     10       5.8832     -0.00000
     11       6.6863     -0.00000
     12       7.9001     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3409      1.00000
      2      -7.9826      1.00000
      3      -5.9887      1.00000
      4      -3.1494      1.00000
      5       0.1127      1.00000
      6       3.8864     -0.00000
      7       6.0319     -0.00000
      8       6.9674     -0.00000
      9       7.0149     -0.00000
     10       8.0578     -0.00000
     11       8.1530      0.00000
     12       8.4109      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3409      1.00000
      2      -7.9826      1.00000
      3      -5.9887      1.00000
      4      -3.1494      1.00000
      5       0.1127      1.00000
      6       3.8864     -0.00000
      7       6.0319     -0.00000
      8       6.9674     -0.00000
      9       7.0149     -0.00000
     10       8.0578     -0.00000
     11       8.1530      0.00000
     12       8.4109      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3409      1.00000
      2      -7.9826      1.00000
      3      -5.9887      1.00000
      4      -3.1494      1.00000
      5       0.1127      1.00000
      6       3.8864     -0.00000
      7       6.0319     -0.00000
      8       6.9674     -0.00000
      9       7.0149     -0.00000
     10       8.0578     -0.00000
     11       8.1530      0.00000
     12       8.4109      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5890      1.00000
      2      -7.2276      1.00000
      3      -5.2306      1.00000
      4      -2.3893      1.00000
      5       0.8379      1.00000
      6       4.2485     -0.00000
      7       5.1042     -0.00000
      8       6.0724     -0.00000
      9       6.3801     -0.00000
     10       7.0145     -0.00000
     11       7.3683     -0.00000
     12       8.0571     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3204      1.00000
      3      -4.3219      1.00000
      4      -1.4925      1.00000
      5       1.6079      1.00000
      6       2.9166     -0.03078
      7       4.2205     -0.00000
      8       5.1885     -0.00000
      9       5.9496     -0.00000
     10       6.0678     -0.00000
     11       7.0747     -0.00000
     12       7.7009     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6288      1.00000
      2      -5.2610      1.00000
      3      -3.2666      1.00000
      4      -0.5159      1.00000
      5       0.8880      1.00000
      6       2.2598      1.01235
      7       3.0087     -0.01138
      8       4.2512     -0.00000
      9       5.0953     -0.00000
     10       6.2536     -0.00000
     11       6.6964     -0.00000
     12       7.3732     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6774     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6773     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6774     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6774     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6774     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0515      1.00000
      3      -2.0836      1.00000
      4      -0.9420      1.00000
      5       0.2075      1.00000
      6       1.1744      1.00000
      7       2.5823      0.70090
      8       3.9298     -0.00000
      9       4.7624     -0.00000
     10       5.4381     -0.00000
     11       6.4530     -0.00000
     12       7.6774     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.7038      1.00000
      3      -2.5515      1.00000
      4      -1.3288      1.00000
      5      -0.6396      1.00000
      6       0.9448      1.00000
      7       2.2921      1.01866
      8       3.6040     -0.00000
      9       4.7225     -0.00000
     10       5.4530     -0.00000
     11       6.2286     -0.00000
     12       6.8359     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7606      1.00000
      2      -6.3961      1.00000
      3      -4.3975      1.00000
      4      -1.5644      1.00000
      5       1.5909      1.00000
      6       3.9923     -0.00000
      7       4.2248     -0.00000
      8       5.2782     -0.00000
      9       5.4951     -0.00000
     10       6.0228     -0.00000
     11       7.0961     -0.00000
     12       7.4119     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7606      1.00000
      2      -6.3961      1.00000
      3      -4.3975      1.00000
      4      -1.5644      1.00000
      5       1.5909      1.00000
      6       3.9923     -0.00000
      7       4.2248     -0.00000
      8       5.2782     -0.00000
      9       5.4951     -0.00000
     10       6.0228     -0.00000
     11       7.0961     -0.00000
     12       7.4119     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7606      1.00000
      2      -6.3961      1.00000
      3      -4.3975      1.00000
      4      -1.5644      1.00000
      5       1.5909      1.00000
      6       3.9923     -0.00000
      7       4.2248     -0.00000
      8       5.2782     -0.00000
      9       5.4951     -0.00000
     10       6.0228     -0.00000
     11       7.0961     -0.00000
     12       7.4119     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7797      1.00000
      2      -5.4124      1.00000
      3      -3.4161      1.00000
      4      -0.6224      1.00000
      5       1.9562      1.00001
      6       2.7437      0.09770
      7       3.7032     -0.00000
      8       3.7922     -0.00000
      9       4.8969     -0.00000
     10       5.5638     -0.00000
     11       6.5650     -0.00000
     12       7.0162     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2777      1.00000
      3      -2.2960      1.00000
      4       0.1056      1.00000
      5       0.6417      1.00000
      6       1.9043      1.00000
      7       3.1297     -0.00121
      8       3.6574     -0.00000
      9       4.0436     -0.00000
     10       4.8174     -0.00000
     11       6.3814     -0.00000
     12       6.9133     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9977      1.00000
      3      -1.3606      1.00000
      4      -1.0986      1.00000
      5       0.0166      1.00000
      6       1.7268      1.00000
      7       2.2449      1.00985
      8       3.0556     -0.00531
      9       4.3257     -0.00000
     10       5.0818     -0.00000
     11       5.3336     -0.00000
     12       6.5286     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9538      1.00000
      2      -2.8968      1.00000
      3      -1.6225      1.00000
      4      -1.5753      1.00000
      5       0.0525      1.00000
      6       0.9193      1.00000
      7       2.7063      0.20702
      8       2.9525     -0.02287
      9       3.8808     -0.00000
     10       4.7776     -0.00000
     11       6.1611     -0.00000
     12       6.4760     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9538      1.00000
      2      -2.8968      1.00000
      3      -1.6225      1.00000
      4      -1.5753      1.00000
      5       0.0525      1.00000
      6       0.9193      1.00000
      7       2.7063      0.20703
      8       2.9525     -0.02287
      9       3.8808     -0.00000
     10       4.7776     -0.00000
     11       6.1611     -0.00000
     12       6.4760     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9538      1.00000
      2      -2.8968      1.00000
      3      -1.6225      1.00000
      4      -1.5753      1.00000
      5       0.0525      1.00000
      6       0.9193      1.00000
      7       2.7063      0.20703
      8       2.9525     -0.02287
      9       3.8808     -0.00000
     10       4.7776     -0.00000
     11       6.1611     -0.00000
     12       6.4760     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3532      1.00000
      3      -2.3682      1.00000
      4       0.3010      1.00000
      5       1.6006      1.00000
      6       1.9015      1.00000
      7       3.0099     -0.01108
      8       3.2935     -0.00001
      9       4.0219     -0.00000
     10       4.8034     -0.00000
     11       5.6228     -0.00000
     12       7.2689     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3532      1.00000
      3      -2.3682      1.00000
      4       0.3010      1.00000
      5       1.6006      1.00000
      6       1.9015      1.00000
      7       3.0099     -0.01108
      8       3.2935     -0.00001
      9       4.0219     -0.00000
     10       4.8034     -0.00000
     11       5.6228     -0.00000
     12       7.2689     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3532      1.00000
      3      -2.3682      1.00000
      4       0.3010      1.00000
      5       1.6006      1.00000
      6       1.9015      1.00000
      7       3.0099     -0.01108
      8       3.2935     -0.00001
      9       4.0219     -0.00000
     10       4.8034     -0.00000
     11       5.6228     -0.00000
     12       7.2689     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1464      1.00000
      3      -1.2009      1.00000
      4      -0.0518      1.00000
      5       1.0077      1.00000
      6       1.3666      1.00000
      7       2.0504      1.00016
      8       2.7969      0.00294
      9       3.6832     -0.00000
     10       4.9232     -0.00000
     11       5.0871     -0.00000
     12       6.3165     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7526      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7526      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7526      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7526      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7526      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8083      1.00000
      3      -1.6461      1.00000
      4      -0.4533      1.00000
      5       0.2177      1.00000
      6       1.2564      1.00000
      7       1.7526      1.00000
      8       2.3589      1.03305
      9       3.6860     -0.00000
     10       4.6205     -0.00000
     11       5.1522     -0.00000
     12       6.1525     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8764      1.00000
      3      -0.2759      1.00000
      4      -0.2148      1.00000
      5      -0.0647      1.00000
      6       0.9359      1.00000
      7       1.2655      1.00000
      8       2.4772      0.98170
      9       3.6849     -0.00000
     10       3.8186     -0.00000
     11       5.9763     -0.00000
     12       6.2184     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8764      1.00000
      3      -0.2759      1.00000
      4      -0.2148      1.00000
      5      -0.0647      1.00000
      6       0.9359      1.00000
      7       1.2655      1.00000
      8       2.4772      0.98170
      9       3.6849     -0.00000
     10       3.8186     -0.00000
     11       5.9764     -0.00000
     12       6.2192     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8764      1.00000
      3      -0.2759      1.00000
      4      -0.2148      1.00000
      5      -0.0647      1.00000
      6       0.9359      1.00000
      7       1.2655      1.00000
      8       2.4772      0.98170
      9       3.6849     -0.00000
     10       3.8186     -0.00000
     11       5.9758     -0.00000
     12       6.2176     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8300      1.00000
      2      -1.7636      1.00000
      3      -0.5148      1.00000
      4      -0.4887      1.00000
      5      -0.3052      1.00000
      6       0.7178      1.00000
      7       1.4326      1.00000
      8       1.7846      1.00000
      9       3.4589     -0.00000
     10       4.5822     -0.00000
     11       4.8566     -0.00000
     12       6.0305     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8300      1.00000
      2      -1.7636      1.00000
      3      -0.5148      1.00000
      4      -0.4887      1.00000
      5      -0.3052      1.00000
      6       0.7178      1.00000
      7       1.4326      1.00000
      8       1.7846      1.00000
      9       3.4589     -0.00000
     10       4.5822     -0.00000
     11       4.8566     -0.00000
     12       6.0305     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8300      1.00000
      2      -1.7636      1.00000
      3      -0.5148      1.00000
      4      -0.4887      1.00000
      5      -0.3052      1.00000
      6       0.7178      1.00000
      7       1.4326      1.00000
      8       1.7846      1.00000
      9       3.4589     -0.00000
     10       4.5822     -0.00000
     11       4.8566     -0.00000
     12       6.0305     -0.00000


--------------------------------------------------------------------------------------------------------


 soft charge-density along one line, spin component           1
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 soft charge-density along one line, spin component           2
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 pseudopotential strength for first ion, spin component:           1
  8.085  13.802  -0.000  -0.002   0.000  -0.000  -0.006   0.000
 13.802  23.556  -0.000  -0.003   0.000  -0.000  -0.010   0.000
 -0.000  -0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880   0.000  -0.000   5.472   0.000
  0.000   0.000   0.000   0.000   1.879   0.000   0.000   5.469
 -0.000  -0.000   5.469  -0.000   0.000  15.775  -0.000   0.000
 -0.006  -0.010  -0.000   5.472   0.000  -0.000  15.784   0.000
  0.000   0.000   0.000   0.000   5.469   0.000   0.000  15.775
 pseudopotential strength for first ion, spin component:           2
  8.085  13.802  -0.000  -0.002   0.000  -0.000  -0.006   0.000
 13.802  23.556  -0.000  -0.003   0.000  -0.000  -0.010   0.000
 -0.000  -0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880   0.000  -0.000   5.472   0.000
  0.000   0.000   0.000   0.000   1.879   0.000   0.000   5.469
 -0.000  -0.000   5.469  -0.000   0.000  15.775  -0.000   0.000
 -0.006  -0.010  -0.000   5.472   0.000  -0.000  15.784   0.000
  0.000   0.000   0.000   0.000   5.469   0.000   0.000  15.775
 total augmentation occupancy for first ion, spin component:           1
116.851 -62.406  -0.000  -0.170  -0.000   0.000  -0.009   0.000
-62.406  33.329   0.000   0.081   0.000  -0.000   0.006  -0.000
 -0.000   0.000   2.103   0.000  -0.000  -0.326  -0.000   0.000
 -0.170   0.081   0.000   1.665   0.000  -0.000  -0.256  -0.000
 -0.000   0.000  -0.000   0.000   2.103   0.000  -0.000  -0.326
  0.000  -0.000  -0.326  -0.000   0.000   0.051   0.000  -0.000
 -0.009   0.006  -0.000  -0.256  -0.000   0.000   0.039   0.000
  0.000  -0.000   0.000  -0.000  -0.326  -0.000   0.000   0.051
 total augmentation occupancy for first ion, spin component:           2
 -0.000   0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000
  0.000  -0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000
  0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000  -0.000
  0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000  -0.000
  0.000  -0.000   0.000   0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000  -0.000  -0.000   0.000   0.000   0.000  -0.000


------------------------ aborting loop because EDIFF is reached ----------------------------------------


    FORLOC:  cpu time      0.0008: real time      0.0008
    FORHF :  cpu time   1059.5099: real time   1063.6763
    FORNL :  cpu time      0.2633: real time      0.2648
    FORCOR:  cpu time      1.1764: real time      1.1798
    OFIELD:  cpu time      0.0001: real time      0.0001

 VOLUME and BASIS-vectors are now :
 -----------------------------------------------------------------------------
  energy-cutoff  :      400.00
  volume of cell :      120.20
      direct lattice vectors                 reciprocal lattice vectors
     2.857459769  0.000000000  0.000000000     0.349961183 -0.202050183  0.000000000
     1.428729885  2.474632750  0.000000000     0.000000000  0.404100366  0.000000000
     0.000000000  0.000000000 16.999318395     0.000000000  0.000000000  0.058825888

  length of vectors
     2.857459769  2.857459769 16.999318395     0.404100366  0.404100366  0.058825888


 FORCES acting on ions:
    Electron-Ion                     Ewald-Force                    Non-Local-Force
 -----------------------------------------------------------------------------------------------
   -.658E-06 0.526E-06 0.156E+03   0.410E-13 0.247E-13 -.155E+03   0.726E-06 -.590E-06 -.113E+01
   -.273E-05 -.410E-06 0.520E+02   -.135E-12 -.737E-13 -.520E+02   0.284E-05 0.435E-06 0.108E+00
   0.217E-07 -.180E-06 -.531E+02   0.134E-12 0.808E-13 0.530E+02   0.358E-06 0.509E-07 0.103E+00
   -.861E-06 0.668E-06 -.155E+03   -.389E-13 -.270E-13 0.154E+03   0.106E-05 -.804E-06 0.915E+00
 -----------------------------------------------------------------------------------------------
   -.427E-05 0.760E-06 0.259E-02   0.721E-15 0.484E-14 -.284E-13   0.498E-05 -.907E-06 0.203E-02
 
 
 POSITION                                       TOTAL-FORCE (eV/Angst)
 -----------------------------------------------------------------------------------
      0.00000      0.00000      0.00000        -0.000000     -0.000000     -0.106636
      1.42873      0.82488      2.33311        -0.000001     -0.000000      0.110693
      2.85746      1.64976      4.64076         0.000001      0.000000     -0.007373
      0.00000      0.00000      7.01413        -0.000000     -0.000000      0.003316
 -----------------------------------------------------------------------------------
    total drift:                                0.000001     -0.000000      0.005154


--------------------------------------------------------------------------------------------------------



  FREE ENERGIE OF THE ION-ELECTRON SYSTEM (eV)
  ---------------------------------------------------
  free  energy   TOTEN  =       -10.94945436 eV

  energy  without entropy=      -10.94977469  energy(sigma->0) =      -10.94956114
 
 d Force = 0.1393307E-02[ 0.149E-03, 0.264E-02]  d Energy = 0.1483457E-02-0.901E-04
 d Force = 0.5745174E+00[ 0.567E+00, 0.582E+00]  d Ewald  = 0.5745224E+00-0.496E-05


--------------------------------------------------------------------------------------------------------


    POTLOK:  cpu time      1.1747: real time      1.1782


--------------------------------------------------------------------------------------------------------


 Quasi-Newton relaxation of ions (Broydens 2nd method)
  g(Force)  = 0.315E-05   g(Stress)= 0.000E+00

 retain information from N=  1 steps
 eigenvalues of (default step * inverse Hessian matrix)
  average eigenvalue of G=   2.8440
 eigenvalue spectrum of G is  2.8440


--------------------------------------------------------------------------------------------------------


    WAVPRE:  cpu time      0.0037: real time      0.0979
    FEWALD:  cpu time      0.0002: real time      0.0002
    ORTHCH:  cpu time      0.0925: real time      0.0928
    POTLOK:  cpu time      1.1765: real time      1.1800
    EDDIAG:  cpu time   1294.6625: real time   1299.9255
    CHARGE:  cpu time      0.2435: real time      0.2446
 writing wavefunctions
     LOOP+:  cpu time  20479.6283: real time  20563.3092


--------------------------------------- Iteration      4(   1)  ---------------------------------------


    POTLOK:  cpu time      0.3867: real time      0.3882
    SETDIJ:  cpu time      0.7902: real time      0.7923
    TRIAL :  cpu time   1293.7801: real time   1299.0570
    CORREC:  cpu time      0.0065: real time      0.0065
    CHARGE:  cpu time      0.2437: real time      0.2447
    --------------------------------------------
      LOOP:  cpu time   1295.2165: real time   1300.4980

 eigenvalue-minimisations  :     0
 total energy-change (2. order) : 0.1865903E-04  (-0.3194416E-04)
 number of electron      12.0000000 magnetization      -0.0000002
 augmentation part       -0.0019027 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.62251006
  -Hartree energ DENC   =      -508.06397869
  -exchange      EXHF   =        26.47848033
  -V(xc)+E(xc)   XCENC  =       -66.89555099
  PAW double counting   =     82025.81747093   -81945.05380660
  entropy T*S    EENTRO =         0.00032664
  eigenvalues    EBANDS =       -34.76431081
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94942893 eV

  energy without entropy =      -10.94975557  energy(sigma->0) =      -10.94953781
  exchange ACFDT corr.  =        -0.00055068  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      4(   2)  ---------------------------------------


    POTLOK:  cpu time      0.3854: real time      0.3867
    SETDIJ:  cpu time      0.7899: real time      0.7920
    TRIAL :  cpu time   1293.4404: real time   1298.6845
    CORREC:  cpu time      0.0066: real time      0.0067
    CHARGE:  cpu time      0.2430: real time      0.2440
    --------------------------------------------
      LOOP:  cpu time   1294.8657: real time   1300.1142

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1854324E-04  (-0.1590588E-04)
 number of electron      12.0000000 magnetization      -0.0000002
 augmentation part       -0.0018999 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.62251006
  -Hartree energ DENC   =      -508.03113408
  -exchange      EXHF   =        26.47822844
  -V(xc)+E(xc)   XCENC  =       -66.89565090
  PAW double counting   =     82029.29706690   -81948.53341722
  entropy T*S    EENTRO =         0.00032927
  eigenvalues    EBANDS =       -34.79681046
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94944747 eV

  energy without entropy =      -10.94977674  energy(sigma->0) =      -10.94955723
  exchange ACFDT corr.  =        -0.00054908  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      4(   3)  ---------------------------------------


    POTLOK:  cpu time      0.3859: real time      0.3873
    SETDIJ:  cpu time      0.7927: real time      0.7947
    TRIAL :  cpu time   1294.2670: real time   1299.5116
    CORREC:  cpu time      0.0063: real time      0.0064
    CHARGE:  cpu time      0.2418: real time      0.2428
    --------------------------------------------
      LOOP:  cpu time   1295.6944: real time   1300.9434

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1164697E-04  (-0.1007417E-04)
 number of electron      12.0000000 magnetization      -0.0000002
 augmentation part       -0.0018978 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.62251006
  -Hartree energ DENC   =      -508.00648159
  -exchange      EXHF   =        26.47802903
  -V(xc)+E(xc)   XCENC  =       -66.89573716
  PAW double counting   =     82034.26104682   -81953.49742346
  entropy T*S    EENTRO =         0.00033016
  eigenvalues    EBANDS =       -34.82116525
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94945912 eV

  energy without entropy =      -10.94978928  energy(sigma->0) =      -10.94956917
  exchange ACFDT corr.  =        -0.00054806  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      4(   4)  ---------------------------------------


    POTLOK:  cpu time      0.3860: real time      0.3874
    SETDIJ:  cpu time      0.7902: real time      0.7923
    TRIAL :  cpu time   1292.7347: real time   1297.9800
    CORREC:  cpu time      0.0064: real time      0.0064
    EDDIAG:  cpu time   1293.2029: real time   1298.4946
    CHARGE:  cpu time      0.2434: real time      0.2444
    --------------------------------------------
      LOOP:  cpu time   2587.3641: real time   2597.9057

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.5640206E-05  (-0.4270757E-05)
 number of electron      12.0000000 magnetization      -0.0000002
 augmentation part       -0.0018960 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.62251006
  -Hartree energ DENC   =      -508.00309193
  -exchange      EXHF   =        26.47805857
  -V(xc)+E(xc)   XCENC  =       -66.89576387
  PAW double counting   =     82039.30881611   -81958.54520809
  entropy T*S    EENTRO =         0.00032965
  eigenvalues    EBANDS =       -34.82448584
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94946476 eV

  energy without entropy =      -10.94979441  energy(sigma->0) =      -10.94957464
  exchange ACFDT corr.  =        -0.00054768  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------


  average scaling for gradient   0.9755


 average (electrostatic) potential at core
  the test charge radii are     1.0406
  (the norm of the test charge is              1.0000)
       1 -70.4262       2 -70.3871       3 -70.4014       4 -70.4502
 
 
 
 E-fermi :   2.6320     XC(G=0):  -4.7786     alpha+bet : -8.1680

 Fermi energy:         2.6320480911

 spin component 1

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3684      1.00000
      2     -10.0149      1.00000
      3      -8.0356      1.00000
      4      -5.2261      1.00000
      5      -1.9160      1.00000
      6       2.0381      1.00011
      7       4.5157     -0.00000
      8       6.5237     -0.00000
      9       6.7151     -0.00000
     10      10.8421      0.00000
     11      10.8657      0.00000
     12      15.5343      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2934      1.00000
      2      -9.9397      1.00000
      3      -7.9598      1.00000
      4      -5.1487      1.00000
      5      -1.8400      1.00000
      6       2.1138      1.00077
      7       4.5800     -0.00000
      8       6.5864     -0.00000
      9       6.7764     -0.00000
     10      10.8895      0.00000
     11      10.9213      0.00000
     12      13.9319      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2934      1.00000
      2      -9.9397      1.00000
      3      -7.9598      1.00000
      4      -5.1487      1.00000
      5      -1.8400      1.00000
      6       2.1138      1.00077
      7       4.5800     -0.00000
      8       6.5864     -0.00000
      9       6.7764     -0.00000
     10      10.8895      0.00000
     11      10.9213      0.00000
     12      13.9319      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2934      1.00000
      2      -9.9397      1.00000
      3      -7.9598      1.00000
      4      -5.1487      1.00000
      5      -1.8400      1.00000
      6       2.1138      1.00077
      7       4.5800     -0.00000
      8       6.5864     -0.00000
      9       6.7764     -0.00000
     10      10.8895      0.00000
     11      10.9213      0.00000
     12      13.9319      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0684      1.00000
      2      -9.7139      1.00000
      3      -7.7326      1.00000
      4      -4.9167      1.00000
      5      -1.6121      1.00000
      6       2.3374      1.02890
      7       4.7717     -0.00000
      8       6.7728     -0.00000
      9       6.9581     -0.00000
     10      10.9742      0.00000
     11      11.0812      0.00000
     12      11.9656      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0684      1.00000
      2      -9.7139      1.00000
      3      -7.7326      1.00000
      4      -4.9167      1.00000
      5      -1.6121      1.00000
      6       2.3374      1.02890
      7       4.7717     -0.00000
      8       6.7728     -0.00000
      9       6.9581     -0.00000
     10      10.9742      0.00000
     11      11.0812      0.00000
     12      11.9656      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0684      1.00000
      2      -9.7139      1.00000
      3      -7.7326      1.00000
      4      -4.9167      1.00000
      5      -1.6121      1.00000
      6       2.3374      1.02890
      7       4.7717     -0.00000
      8       6.7728     -0.00000
      9       6.9581     -0.00000
     10      10.9742      0.00000
     11      11.0812      0.00000
     12      11.9656      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6933      1.00000
      2      -9.3374      1.00000
      3      -7.3538      1.00000
      4      -4.5309      1.00000
      5      -1.2336      1.00000
      6       2.6994      0.23091
      7       5.0863     -0.00000
      8       7.0728     -0.00000
      9       7.2473     -0.00000
     10       9.7560      0.00000
     11      10.6836      0.00000
     12      12.2931      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6933      1.00000
      2      -9.3374      1.00000
      3      -7.3538      1.00000
      4      -4.5309      1.00000
      5      -1.2336      1.00000
      6       2.6994      0.23091
      7       5.0863     -0.00000
      8       7.0728     -0.00000
      9       7.2473     -0.00000
     10       9.7560      0.00000
     11      10.6835      0.00000
     12      11.9225      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6933      1.00000
      2      -9.3374      1.00000
      3      -7.3538      1.00000
      4      -4.5309      1.00000
      5      -1.2336      1.00000
      6       2.6994      0.23091
      7       5.0863     -0.00000
      8       7.0728     -0.00000
      9       7.2473     -0.00000
     10       9.7560      0.00000
     11      10.6835      0.00000
     12      11.7885      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1680      1.00000
      2      -8.8102      1.00000
      3      -6.8235      1.00000
      4      -3.9923      1.00000
      5      -0.7068      1.00000
      6       3.1823     -0.00035
      7       5.5040     -0.00000
      8       7.2078     -0.00000
      9       7.5868     -0.00000
     10       8.1076      0.00000
     11       8.7559      0.00000
     12      10.4276      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1680      1.00000
      2      -8.8102      1.00000
      3      -6.8235      1.00000
      4      -3.9923      1.00000
      5      -0.7068      1.00000
      6       3.1823     -0.00035
      7       5.5040     -0.00000
      8       7.2078     -0.00000
      9       7.5868     -0.00000
     10       8.1076      0.00000
     11       8.7559      0.00000
     12      10.4276      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1680      1.00000
      2      -8.8102      1.00000
      3      -6.8235      1.00000
      4      -3.9923      1.00000
      5      -0.7068      1.00000
      6       3.1823     -0.00035
      7       5.5040     -0.00000
      8       7.2078     -0.00000
      9       7.5868     -0.00000
     10       8.1076      0.00000
     11       8.7559      0.00000
     12      10.4276      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4922      1.00000
      2      -8.1316      1.00000
      3      -6.1413      1.00000
      4      -3.3026      1.00000
      5      -0.0377      1.00000
      6       3.7221     -0.00000
      7       5.3961     -0.00000
      8       6.2534     -0.00000
      9       6.7417     -0.00000
     10       8.1015      0.00000
     11       8.2420      0.00000
     12       8.6133      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4922      1.00000
      2      -8.1316      1.00000
      3      -6.1413      1.00000
      4      -3.3026      1.00000
      5      -0.0377      1.00000
      6       3.7221     -0.00000
      7       5.3961     -0.00000
      8       6.2534     -0.00000
      9       6.7417     -0.00000
     10       8.1015      0.00000
     11       8.2420      0.00000
     12       8.6133      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4922      1.00000
      2      -8.1316      1.00000
      3      -6.1413      1.00000
      4      -3.3026      1.00000
      5      -0.0377      1.00000
      6       3.7221     -0.00000
      7       5.3961     -0.00000
      8       6.2534     -0.00000
      9       6.7417     -0.00000
     10       8.1015      0.00000
     11       8.2420      0.00000
     12       8.6133      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6653      1.00000
      2      -7.3012      1.00000
      3      -5.3074      1.00000
      4      -2.4667      1.00000
      5       0.7475      1.00000
      6       3.2534     -0.00005
      7       4.5119     -0.00000
      8       5.0322     -0.00000
      9       6.4623     -0.00000
     10       6.9476     -0.00000
     11       8.7898      0.00000
     12      10.5811      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6653      1.00000
      2      -7.3012      1.00000
      3      -5.3074      1.00000
      4      -2.4667      1.00000
      5       0.7475      1.00000
      6       3.2534     -0.00005
      7       4.5119     -0.00000
      8       5.0322     -0.00000
      9       6.4623     -0.00000
     10       6.9476     -0.00000
     11       8.7894      0.00000
     12      10.5111      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6653      1.00000
      2      -7.3012      1.00000
      3      -5.3074      1.00000
      4      -2.4667      1.00000
      5       0.7475      1.00000
      6       3.2534     -0.00005
      7       4.5119     -0.00000
      8       5.0322     -0.00000
      9       6.4623     -0.00000
     10       6.9476     -0.00000
     11       8.7900      0.00000
     12      10.6746      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6864      1.00000
      2      -6.3184      1.00000
      3      -4.3232      1.00000
      4      -1.5044      1.00000
      5       1.1141      1.00000
      6       1.9686      1.00001
      7       2.9089     -0.03209
      8       4.6966     -0.00000
      9       5.5683     -0.00000
     10       7.2784     -0.00000
     11       7.6759     -0.00000
     12      10.2756      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6864      1.00000
      2      -6.3184      1.00000
      3      -4.3232      1.00000
      4      -1.5044      1.00000
      5       1.1141      1.00000
      6       1.9686      1.00001
      7       2.9089     -0.03209
      8       4.6966     -0.00000
      9       5.5683     -0.00000
     10       7.2784     -0.00000
     11       7.6759     -0.00000
     12      10.2771      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6864      1.00000
      2      -6.3184      1.00000
      3      -4.3232      1.00000
      4      -1.5044      1.00000
      5       1.1141      1.00000
      6       1.9686      1.00001
      7       2.9089     -0.03209
      8       4.6966     -0.00000
      9       5.5683     -0.00000
     10       7.2784     -0.00000
     11       7.6759     -0.00000
     12      10.2776      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5547      1.00000
      2      -5.1834      1.00000
      3      -3.1958      1.00000
      4      -0.7658      1.00000
      5      -0.2272      1.00000
      6       1.0676      1.00000
      7       2.8551     -0.03344
      8       3.0983     -0.00233
      9       5.5778     -0.00000
     10       6.5512     -0.00000
     11       8.3019      0.00000
     12       9.8878      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5547      1.00000
      2      -5.1834      1.00000
      3      -3.1958      1.00000
      4      -0.7658      1.00000
      5      -0.2272      1.00000
      6       1.0676      1.00000
      7       2.8551     -0.03344
      8       3.0983     -0.00233
      9       5.5778     -0.00000
     10       6.5512     -0.00000
     11       8.3019      0.00000
     12       9.8842      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5547      1.00000
      2      -5.1834      1.00000
      3      -3.1958      1.00000
      4      -0.7658      1.00000
      5      -0.2272      1.00000
      6       1.0676      1.00000
      7       2.8551     -0.03344
      8       3.0983     -0.00233
      9       5.5778     -0.00000
     10       6.5512     -0.00000
     11       8.3019      0.00000
     12       9.8212      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2700      1.00000
      2      -3.9003      1.00000
      3      -2.2642      1.00000
      4      -1.9816      1.00000
      5      -0.8649      1.00000
      6       0.9077      1.00000
      7       1.5232      1.00000
      8       4.0024     -0.00000
      9       4.1908     -0.00000
     10       6.8812     -0.00000
     11       7.6006     -0.00000
     12       9.7996      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2700      1.00000
      2      -3.9003      1.00000
      3      -2.2642      1.00000
      4      -1.9816      1.00000
      5      -0.8649      1.00000
      6       0.9077      1.00000
      7       1.5232      1.00000
      8       4.0024     -0.00000
      9       4.1908     -0.00000
     10       6.8812     -0.00000
     11       7.6006     -0.00000
     12       9.7996      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2700      1.00000
      2      -3.9003      1.00000
      3      -2.2642      1.00000
      4      -1.9816      1.00000
      5      -0.8649      1.00000
      6       0.9077      1.00000
      7       1.5232      1.00000
      8       4.0024     -0.00000
      9       4.1908     -0.00000
     10       6.8812     -0.00000
     11       7.6006     -0.00000
     12       9.7996      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8586      1.00000
      2      -3.8114      1.00000
      3      -2.5279      1.00000
      4      -2.4568      1.00000
      5      -0.8068      1.00000
      6       0.0356      1.00000
      7       2.3627      1.03359
      8       2.7222      0.15518
      9       5.2676     -0.00000
     10       5.7024     -0.00000
     11       8.4675      0.00000
     12       9.1703      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8586      1.00000
      2      -3.8114      1.00000
      3      -2.5279      1.00000
      4      -2.4568      1.00000
      5      -0.8068      1.00000
      6       0.0356      1.00000
      7       2.3627      1.03359
      8       2.7222      0.15518
      9       5.2676     -0.00000
     10       5.7024     -0.00000
     11       8.4675      0.00000
     12       9.6690      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8586      1.00000
      2      -3.8114      1.00000
      3      -2.5279      1.00000
      4      -2.4568      1.00000
      5      -0.8068      1.00000
      6       0.0356      1.00000
      7       2.3627      1.03359
      8       2.7222      0.15518
      9       5.2676     -0.00000
     10       5.7024     -0.00000
     11       8.4675      0.00000
     12       9.6681      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1434      1.00000
      2      -9.7892      1.00000
      3      -7.8083      1.00000
      4      -4.9940      1.00000
      5      -1.6880      1.00000
      6       2.2634      1.01288
      7       4.7080     -0.00000
      8       6.7111     -0.00000
      9       6.8980     -0.00000
     10      10.9716      0.00000
     11      11.0262      0.00000
     12      12.9511      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1434      1.00000
      2      -9.7892      1.00000
      3      -7.8083      1.00000
      4      -4.9940      1.00000
      5      -1.6880      1.00000
      6       2.2634      1.01288
      7       4.7080     -0.00000
      8       6.7111     -0.00000
      9       6.8980     -0.00000
     10      10.9716      0.00000
     11      11.0262      0.00000
     12      12.9361      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1434      1.00000
      2      -9.7892      1.00000
      3      -7.8083      1.00000
      4      -4.9940      1.00000
      5      -1.6880      1.00000
      6       2.2634      1.01288
      7       4.7080     -0.00000
      8       6.7111     -0.00000
      9       6.8980     -0.00000
     10      10.9717      0.00000
     11      11.0262      0.00000
     12      12.9373      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1785      0.00000
     12      11.4789      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1785      0.00000
     12      11.4788      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1785      0.00000
     12      11.4789      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1785      0.00000
     12      11.4789      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1785      0.00000
     12      11.4788      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1785      0.00000
     12      11.4789      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0450      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0450      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0450      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0450      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0450      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0450      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4377      0.00000
     12       9.1557      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4377      0.00000
     12       9.1555      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4377      0.00000
     12       9.1556      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4377      0.00000
     12       9.1555      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4377      0.00000
     12       9.1557      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4377      0.00000
     12       9.1557      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2040     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2039     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2039     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2039     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2040     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2039     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4682      1.00000
      2      -9.1115      1.00000
      3      -7.1266      1.00000
      4      -4.2999      1.00000
      5      -1.0072      1.00000
      6       2.9112     -0.03187
      7       5.2725     -0.00000
      8       7.2508     -0.00000
      9       7.4119     -0.00000
     10       9.9070      0.00000
     11       9.9296      0.00000
     12      10.8599      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4682      1.00000
      2      -9.1115      1.00000
      3      -7.1266      1.00000
      4      -4.2999      1.00000
      5      -1.0072      1.00000
      6       2.9112     -0.03187
      7       5.2725     -0.00000
      8       7.2508     -0.00000
      9       7.4119     -0.00000
     10       9.9069      0.00000
     11       9.9296      0.00000
     12      10.8720      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4682      1.00000
      2      -9.1115      1.00000
      3      -7.1266      1.00000
      4      -4.2999      1.00000
      5      -1.0072      1.00000
      6       2.9112     -0.03187
      7       5.2725     -0.00000
      8       7.2508     -0.00000
      9       7.4119     -0.00000
     10       9.9068      0.00000
     11       9.9298      0.00000
     12      10.8949      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4252      0.00000
     12       8.5603      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4252      0.00000
     12       8.5603      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4252      0.00000
     12       8.5603      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4252      0.00000
     12       8.5603      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4252      0.00000
     12       8.5603      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4252      0.00000
     12       8.5603      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.3121      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.3121      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.3121      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.3121      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.3121      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.3121      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6323      1.00000
      2      -3.5827      1.00000
      3      -2.3002      1.00000
      4      -2.2357      1.00000
      5      -0.5905      1.00000
      6       0.2610      1.00000
      7       2.5596      0.78379
      8       2.9084     -0.03224
      9       5.3771     -0.00000
     10       5.8829     -0.00000
     11       6.6854     -0.00000
     12       7.9017     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6323      1.00000
      2      -3.5827      1.00000
      3      -2.3002      1.00000
      4      -2.2357      1.00000
      5      -0.5905      1.00000
      6       0.2610      1.00000
      7       2.5596      0.78379
      8       2.9084     -0.03224
      9       5.3771     -0.00000
     10       5.8829     -0.00000
     11       6.6854     -0.00000
     12       7.9017     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6323      1.00000
      2      -3.5827      1.00000
      3      -2.3002      1.00000
      4      -2.2357      1.00000
      5      -0.5905      1.00000
      6       0.2610      1.00000
      7       2.5596      0.78379
      8       2.9084     -0.03224
      9       5.3771     -0.00000
     10       5.8829     -0.00000
     11       6.6854     -0.00000
     12       7.9017     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3419      1.00000
      2      -7.9808      1.00000
      3      -5.9897      1.00000
      4      -3.1496      1.00000
      5       0.1125      1.00000
      6       3.8863     -0.00000
      7       6.0318     -0.00000
      8       6.9662     -0.00000
      9       7.0142     -0.00000
     10       8.0596     -0.00000
     11       8.1543      0.00000
     12       8.4133      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3419      1.00000
      2      -7.9808      1.00000
      3      -5.9897      1.00000
      4      -3.1496      1.00000
      5       0.1125      1.00000
      6       3.8863     -0.00000
      7       6.0318     -0.00000
      8       6.9662     -0.00000
      9       7.0142     -0.00000
     10       8.0596     -0.00000
     11       8.1543      0.00000
     12       8.4133      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3419      1.00000
      2      -7.9808      1.00000
      3      -5.9897      1.00000
      4      -3.1496      1.00000
      5       0.1125      1.00000
      6       3.8863     -0.00000
      7       6.0318     -0.00000
      8       6.9662     -0.00000
      9       7.0142     -0.00000
     10       8.0596     -0.00000
     11       8.1543      0.00000
     12       8.4133      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70333
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70333
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70333
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70333
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70333
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70333
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7615      1.00000
      2      -6.3943      1.00000
      3      -4.3986      1.00000
      4      -1.5646      1.00000
      5       1.5907      1.00000
      6       3.9911     -0.00000
      7       4.2241     -0.00000
      8       5.2794     -0.00000
      9       5.4970     -0.00000
     10       6.0232     -0.00000
     11       7.0952     -0.00000
     12       7.4110     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7615      1.00000
      2      -6.3943      1.00000
      3      -4.3986      1.00000
      4      -1.5646      1.00000
      5       1.5907      1.00000
      6       3.9911     -0.00000
      7       4.2241     -0.00000
      8       5.2794     -0.00000
      9       5.4970     -0.00000
     10       6.0232     -0.00000
     11       7.0952     -0.00000
     12       7.4110     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7615      1.00000
      2      -6.3943      1.00000
      3      -4.3986      1.00000
      4      -1.5646      1.00000
      5       1.5907      1.00000
      6       3.9911     -0.00000
      7       4.2241     -0.00000
      8       5.2794     -0.00000
      9       5.4970     -0.00000
     10       6.0232     -0.00000
     11       7.0952     -0.00000
     12       7.4110     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9545      1.00000
      2      -2.8982      1.00000
      3      -1.6204      1.00000
      4      -1.5737      1.00000
      5       0.0516      1.00000
      6       0.9181      1.00000
      7       2.7051      0.20916
      8       2.9530     -0.02265
      9       3.8805     -0.00000
     10       4.7788     -0.00000
     11       6.1613     -0.00000
     12       6.4745     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9545      1.00000
      2      -2.8982      1.00000
      3      -1.6204      1.00000
      4      -1.5737      1.00000
      5       0.0516      1.00000
      6       0.9181      1.00000
      7       2.7051      0.20916
      8       2.9530     -0.02265
      9       3.8805     -0.00000
     10       4.7788     -0.00000
     11       6.1613     -0.00000
     12       6.4745     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9545      1.00000
      2      -2.8982      1.00000
      3      -1.6204      1.00000
      4      -1.5737      1.00000
      5       0.0516      1.00000
      6       0.9181      1.00000
      7       2.7051      0.20916
      8       2.9530     -0.02265
      9       3.8805     -0.00000
     10       4.7788     -0.00000
     11       6.1613     -0.00000
     12       6.4745     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7223      1.00000
      2      -4.3513      1.00000
      3      -2.3693      1.00000
      4       0.3008      1.00000
      5       1.5998      1.00000
      6       1.9004      1.00000
      7       3.0115     -0.01080
      8       3.2950     -0.00001
      9       4.0220     -0.00000
     10       4.8025     -0.00000
     11       5.6215     -0.00000
     12       7.2690     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7223      1.00000
      2      -4.3513      1.00000
      3      -2.3693      1.00000
      4       0.3008      1.00000
      5       1.5998      1.00000
      6       1.9004      1.00000
      7       3.0115     -0.01080
      8       3.2950     -0.00001
      9       4.0220     -0.00000
     10       4.8025     -0.00000
     11       5.6215     -0.00000
     12       7.2690     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7223      1.00000
      2      -4.3513      1.00000
      3      -2.3693      1.00000
      4       0.3008      1.00000
      5       1.5998      1.00000
      6       1.9004      1.00000
      7       3.0115     -0.01080
      8       3.2950     -0.00001
      9       4.0220     -0.00000
     10       4.8025     -0.00000
     11       5.6215     -0.00000
     12       7.2690     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2258      1.00000
      2      -1.8745      1.00000
      3      -0.2767      1.00000
      4      -0.2161      1.00000
      5      -0.0656      1.00000
      6       0.9378      1.00000
      7       1.2670      1.00000
      8       2.4763      0.98298
      9       3.6846     -0.00000
     10       3.8175     -0.00000
     11       5.9763     -0.00000
     12       6.2159     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2258      1.00000
      2      -1.8745      1.00000
      3      -0.2767      1.00000
      4      -0.2161      1.00000
      5      -0.0656      1.00000
      6       0.9378      1.00000
      7       1.2670      1.00000
      8       2.4763      0.98298
      9       3.6846     -0.00000
     10       3.8175     -0.00000
     11       5.9759     -0.00000
     12       6.2183     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2258      1.00000
      2      -1.8745      1.00000
      3      -0.2767      1.00000
      4      -0.2161      1.00000
      5      -0.0656      1.00000
      6       0.9378      1.00000
      7       1.2670      1.00000
      8       2.4763      0.98298
      9       3.6846     -0.00000
     10       3.8175     -0.00000
     11       5.9768     -0.00000
     12       6.2143     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8308      1.00000
      2      -1.7650      1.00000
      3      -0.5128      1.00000
      4      -0.4873      1.00000
      5      -0.3059      1.00000
      6       0.7187      1.00000
      7       1.4326      1.00000
      8       1.7836      1.00000
      9       3.4576     -0.00000
     10       4.5823     -0.00000
     11       4.8561     -0.00000
     12       6.0302     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8308      1.00000
      2      -1.7650      1.00000
      3      -0.5128      1.00000
      4      -0.4873      1.00000
      5      -0.3059      1.00000
      6       0.7187      1.00000
      7       1.4326      1.00000
      8       1.7836      1.00000
      9       3.4576     -0.00000
     10       4.5823     -0.00000
     11       4.8561     -0.00000
     12       6.0302     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8308      1.00000
      2      -1.7650      1.00000
      3      -0.5128      1.00000
      4      -0.4873      1.00000
      5      -0.3059      1.00000
      6       0.7187      1.00000
      7       1.4326      1.00000
      8       1.7836      1.00000
      9       3.4576     -0.00000
     10       4.5823     -0.00000
     11       4.8561     -0.00000
     12       6.0302     -0.00000
 Fermi energy:         2.6320480911

 spin component 2

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3684      1.00000
      2     -10.0149      1.00000
      3      -8.0356      1.00000
      4      -5.2261      1.00000
      5      -1.9160      1.00000
      6       2.0381      1.00011
      7       4.5157     -0.00000
      8       6.5237     -0.00000
      9       6.7151     -0.00000
     10      10.8421      0.00000
     11      10.8657      0.00000
     12      15.5301      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2934      1.00000
      2      -9.9397      1.00000
      3      -7.9598      1.00000
      4      -5.1487      1.00000
      5      -1.8400      1.00000
      6       2.1138      1.00077
      7       4.5800     -0.00000
      8       6.5864     -0.00000
      9       6.7764     -0.00000
     10      10.8895      0.00000
     11      10.9213      0.00000
     12      13.9319      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2934      1.00000
      2      -9.9397      1.00000
      3      -7.9598      1.00000
      4      -5.1487      1.00000
      5      -1.8400      1.00000
      6       2.1138      1.00077
      7       4.5800     -0.00000
      8       6.5864     -0.00000
      9       6.7764     -0.00000
     10      10.8895      0.00000
     11      10.9213      0.00000
     12      13.9319      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2934      1.00000
      2      -9.9397      1.00000
      3      -7.9598      1.00000
      4      -5.1487      1.00000
      5      -1.8400      1.00000
      6       2.1138      1.00077
      7       4.5800     -0.00000
      8       6.5864     -0.00000
      9       6.7764     -0.00000
     10      10.8895      0.00000
     11      10.9213      0.00000
     12      13.9319      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0684      1.00000
      2      -9.7139      1.00000
      3      -7.7326      1.00000
      4      -4.9167      1.00000
      5      -1.6121      1.00000
      6       2.3374      1.02890
      7       4.7717     -0.00000
      8       6.7728     -0.00000
      9       6.9581     -0.00000
     10      10.9742      0.00000
     11      11.0812      0.00000
     12      11.9656      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0684      1.00000
      2      -9.7139      1.00000
      3      -7.7326      1.00000
      4      -4.9167      1.00000
      5      -1.6121      1.00000
      6       2.3374      1.02890
      7       4.7717     -0.00000
      8       6.7728     -0.00000
      9       6.9581     -0.00000
     10      10.9742      0.00000
     11      11.0812      0.00000
     12      11.9656      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0684      1.00000
      2      -9.7139      1.00000
      3      -7.7326      1.00000
      4      -4.9167      1.00000
      5      -1.6121      1.00000
      6       2.3374      1.02890
      7       4.7717     -0.00000
      8       6.7728     -0.00000
      9       6.9581     -0.00000
     10      10.9742      0.00000
     11      11.0812      0.00000
     12      11.9656      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6933      1.00000
      2      -9.3374      1.00000
      3      -7.3538      1.00000
      4      -4.5309      1.00000
      5      -1.2336      1.00000
      6       2.6994      0.23091
      7       5.0863     -0.00000
      8       7.0728     -0.00000
      9       7.2473     -0.00000
     10       9.7560      0.00000
     11      10.6835      0.00000
     12      11.8235      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6933      1.00000
      2      -9.3374      1.00000
      3      -7.3538      1.00000
      4      -4.5309      1.00000
      5      -1.2336      1.00000
      6       2.6994      0.23091
      7       5.0863     -0.00000
      8       7.0728     -0.00000
      9       7.2473     -0.00000
     10       9.7560      0.00000
     11      10.6835      0.00000
     12      11.6398      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6933      1.00000
      2      -9.3374      1.00000
      3      -7.3538      1.00000
      4      -4.5309      1.00000
      5      -1.2336      1.00000
      6       2.6994      0.23091
      7       5.0863     -0.00000
      8       7.0728     -0.00000
      9       7.2473     -0.00000
     10       9.7560      0.00000
     11      10.6836      0.00000
     12      12.2018      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1680      1.00000
      2      -8.8102      1.00000
      3      -6.8235      1.00000
      4      -3.9923      1.00000
      5      -0.7068      1.00000
      6       3.1823     -0.00035
      7       5.5040     -0.00000
      8       7.2078     -0.00000
      9       7.5868     -0.00000
     10       8.1076      0.00000
     11       8.7559      0.00000
     12      10.4276      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1680      1.00000
      2      -8.8102      1.00000
      3      -6.8235      1.00000
      4      -3.9923      1.00000
      5      -0.7068      1.00000
      6       3.1823     -0.00035
      7       5.5040     -0.00000
      8       7.2078     -0.00000
      9       7.5868     -0.00000
     10       8.1076      0.00000
     11       8.7559      0.00000
     12      10.4276      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1680      1.00000
      2      -8.8102      1.00000
      3      -6.8235      1.00000
      4      -3.9923      1.00000
      5      -0.7068      1.00000
      6       3.1823     -0.00035
      7       5.5040     -0.00000
      8       7.2078     -0.00000
      9       7.5868     -0.00000
     10       8.1076      0.00000
     11       8.7559      0.00000
     12      10.4276      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4922      1.00000
      2      -8.1316      1.00000
      3      -6.1413      1.00000
      4      -3.3026      1.00000
      5      -0.0377      1.00000
      6       3.7221     -0.00000
      7       5.3961     -0.00000
      8       6.2534     -0.00000
      9       6.7417     -0.00000
     10       8.1015      0.00000
     11       8.2420      0.00000
     12       8.6133      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4922      1.00000
      2      -8.1316      1.00000
      3      -6.1413      1.00000
      4      -3.3026      1.00000
      5      -0.0377      1.00000
      6       3.7221     -0.00000
      7       5.3961     -0.00000
      8       6.2534     -0.00000
      9       6.7417     -0.00000
     10       8.1015      0.00000
     11       8.2420      0.00000
     12       8.6133      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4922      1.00000
      2      -8.1316      1.00000
      3      -6.1413      1.00000
      4      -3.3026      1.00000
      5      -0.0377      1.00000
      6       3.7221     -0.00000
      7       5.3961     -0.00000
      8       6.2534     -0.00000
      9       6.7417     -0.00000
     10       8.1015      0.00000
     11       8.2420      0.00000
     12       8.6133      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6653      1.00000
      2      -7.3012      1.00000
      3      -5.3074      1.00000
      4      -2.4667      1.00000
      5       0.7475      1.00000
      6       3.2534     -0.00005
      7       4.5119     -0.00000
      8       5.0322     -0.00000
      9       6.4623     -0.00000
     10       6.9476     -0.00000
     11       8.7764      0.00000
     12       9.6004      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6653      1.00000
      2      -7.3012      1.00000
      3      -5.3074      1.00000
      4      -2.4667      1.00000
      5       0.7475      1.00000
      6       3.2534     -0.00005
      7       4.5119     -0.00000
      8       5.0322     -0.00000
      9       6.4623     -0.00000
     10       6.9476     -0.00000
     11       8.7883      0.00000
     12      10.1863      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6653      1.00000
      2      -7.3012      1.00000
      3      -5.3074      1.00000
      4      -2.4667      1.00000
      5       0.7475      1.00000
      6       3.2534     -0.00005
      7       4.5119     -0.00000
      8       5.0322     -0.00000
      9       6.4623     -0.00000
     10       6.9476     -0.00000
     11       8.7854      0.00000
     12       9.8204      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6864      1.00000
      2      -6.3184      1.00000
      3      -4.3232      1.00000
      4      -1.5044      1.00000
      5       1.1141      1.00000
      6       1.9686      1.00001
      7       2.9089     -0.03209
      8       4.6966     -0.00000
      9       5.5683     -0.00000
     10       7.2784     -0.00000
     11       7.6759     -0.00000
     12      10.2717      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6864      1.00000
      2      -6.3184      1.00000
      3      -4.3232      1.00000
      4      -1.5044      1.00000
      5       1.1141      1.00000
      6       1.9686      1.00001
      7       2.9089     -0.03209
      8       4.6966     -0.00000
      9       5.5683     -0.00000
     10       7.2784     -0.00000
     11       7.6759     -0.00000
     12      10.2775      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6864      1.00000
      2      -6.3184      1.00000
      3      -4.3232      1.00000
      4      -1.5044      1.00000
      5       1.1141      1.00000
      6       1.9686      1.00001
      7       2.9089     -0.03209
      8       4.6966     -0.00000
      9       5.5683     -0.00000
     10       7.2784     -0.00000
     11       7.6759     -0.00000
     12      10.2776      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5547      1.00000
      2      -5.1834      1.00000
      3      -3.1958      1.00000
      4      -0.7658      1.00000
      5      -0.2272      1.00000
      6       1.0676      1.00000
      7       2.8551     -0.03344
      8       3.0983     -0.00233
      9       5.5778     -0.00000
     10       6.5512     -0.00000
     11       8.3018      0.00000
     12       9.6747      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5547      1.00000
      2      -5.1834      1.00000
      3      -3.1958      1.00000
      4      -0.7658      1.00000
      5      -0.2272      1.00000
      6       1.0676      1.00000
      7       2.8551     -0.03344
      8       3.0983     -0.00233
      9       5.5778     -0.00000
     10       6.5512     -0.00000
     11       8.3018      0.00000
     12       9.7839      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5547      1.00000
      2      -5.1834      1.00000
      3      -3.1958      1.00000
      4      -0.7658      1.00000
      5      -0.2272      1.00000
      6       1.0676      1.00000
      7       2.8551     -0.03344
      8       3.0983     -0.00233
      9       5.5778     -0.00000
     10       6.5512     -0.00000
     11       8.3018      0.00000
     12       9.7847      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2700      1.00000
      2      -3.9003      1.00000
      3      -2.2642      1.00000
      4      -1.9816      1.00000
      5      -0.8649      1.00000
      6       0.9077      1.00000
      7       1.5232      1.00000
      8       4.0024     -0.00000
      9       4.1908     -0.00000
     10       6.8812     -0.00000
     11       7.6006     -0.00000
     12       9.7996      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2700      1.00000
      2      -3.9003      1.00000
      3      -2.2642      1.00000
      4      -1.9816      1.00000
      5      -0.8649      1.00000
      6       0.9077      1.00000
      7       1.5232      1.00000
      8       4.0024     -0.00000
      9       4.1908     -0.00000
     10       6.8812     -0.00000
     11       7.6006     -0.00000
     12       9.7996      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2700      1.00000
      2      -3.9003      1.00000
      3      -2.2642      1.00000
      4      -1.9816      1.00000
      5      -0.8649      1.00000
      6       0.9077      1.00000
      7       1.5232      1.00000
      8       4.0024     -0.00000
      9       4.1908     -0.00000
     10       6.8812     -0.00000
     11       7.6006     -0.00000
     12       9.7996      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8586      1.00000
      2      -3.8114      1.00000
      3      -2.5279      1.00000
      4      -2.4568      1.00000
      5      -0.8068      1.00000
      6       0.0356      1.00000
      7       2.3627      1.03359
      8       2.7222      0.15518
      9       5.2676     -0.00000
     10       5.7024     -0.00000
     11       8.4675      0.00000
     12       9.4596      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8586      1.00000
      2      -3.8114      1.00000
      3      -2.5279      1.00000
      4      -2.4568      1.00000
      5      -0.8068      1.00000
      6       0.0356      1.00000
      7       2.3627      1.03359
      8       2.7222      0.15518
      9       5.2676     -0.00000
     10       5.7024     -0.00000
     11       8.4675      0.00000
     12       9.7040      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8586      1.00000
      2      -3.8114      1.00000
      3      -2.5279      1.00000
      4      -2.4568      1.00000
      5      -0.8068      1.00000
      6       0.0356      1.00000
      7       2.3627      1.03359
      8       2.7222      0.15518
      9       5.2676     -0.00000
     10       5.7024     -0.00000
     11       8.4675      0.00000
     12       9.0356      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1434      1.00000
      2      -9.7892      1.00000
      3      -7.8083      1.00000
      4      -4.9940      1.00000
      5      -1.6880      1.00000
      6       2.2634      1.01288
      7       4.7080     -0.00000
      8       6.7111     -0.00000
      9       6.8980     -0.00000
     10      10.9716      0.00000
     11      11.0262      0.00000
     12      12.9331      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1434      1.00000
      2      -9.7892      1.00000
      3      -7.8083      1.00000
      4      -4.9940      1.00000
      5      -1.6880      1.00000
      6       2.2634      1.01288
      7       4.7080     -0.00000
      8       6.7111     -0.00000
      9       6.8980     -0.00000
     10      10.9716      0.00000
     11      11.0262      0.00000
     12      12.9343      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1434      1.00000
      2      -9.7892      1.00000
      3      -7.8083      1.00000
      4      -4.9940      1.00000
      5      -1.6880      1.00000
      6       2.2634      1.01288
      7       4.7080     -0.00000
      8       6.7111     -0.00000
      9       6.8980     -0.00000
     10      10.9716      0.00000
     11      11.0262      0.00000
     12      12.9410      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1740      0.00000
     12      11.4375      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1740      0.00000
     12      11.4375      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1740      0.00000
     12      11.4375      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1740      0.00000
     12      11.4375      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1740      0.00000
     12      11.4375      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8434      1.00000
      2      -9.4880      1.00000
      3      -7.5053      1.00000
      4      -4.6852      1.00000
      5      -1.3848      1.00000
      6       2.5563      0.79538
      7       4.9615     -0.00000
      8       6.9562     -0.00000
      9       7.1351     -0.00000
     10      10.7065      0.00000
     11      11.1740      0.00000
     12      11.4375      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0451      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0451      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0451      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0451      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0451      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3932      1.00000
      2      -9.0362      1.00000
      3      -7.0508      1.00000
      4      -4.2229      1.00000
      5      -0.9320      1.00000
      6       2.9798     -0.01681
      7       5.3319     -0.00000
      8       7.2865     -0.00000
      9       7.4551     -0.00000
     10       8.8473      0.00000
     11       9.7854      0.00000
     12      11.0451      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7926      1.00000
      2      -8.4333      1.00000
      3      -6.4445      1.00000
      4      -3.6086      1.00000
      5      -0.3332      1.00000
      6       3.5063     -0.00000
      7       5.7394     -0.00000
      8       6.6176     -0.00000
      9       7.7194     -0.00000
     10       7.9021     -0.00000
     11       8.1618      0.00000
     12       9.4921      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4378      0.00000
     12       9.1128      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4378      0.00000
     12       9.1132      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4378      0.00000
     12       9.1113      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4378      0.00000
     12       9.1115      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4378      0.00000
     12       9.1129      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0413      1.00000
      2      -7.6788      1.00000
      3      -5.6864      1.00000
      4      -2.8452      1.00000
      5       0.3999      1.00000
      6       3.8661     -0.00000
      7       4.7796     -0.00000
      8       5.8287     -0.00000
      9       6.5293     -0.00000
     10       7.5519     -0.00000
     11       8.4378      0.00000
     12       9.1095      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2039     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2039     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2039     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2039     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2039     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1384      1.00000
      2      -6.7722      1.00000
      3      -4.7771      1.00000
      4      -1.9420      1.00000
      5       1.1823      1.00000
      6       2.4874      0.96589
      7       3.8154     -0.00000
      8       5.2039     -0.00000
      9       5.6611     -0.00000
     10       7.2917     -0.00000
     11       8.1319      0.00000
     12       8.9423      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58743
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0831      1.00000
      2      -5.7130      1.00000
      3      -3.7198      1.00000
      4      -0.9540      1.00000
      5       0.4446      1.00000
      6       1.8393      1.00000
      7       2.6106      0.58744
      8       3.8705     -0.00000
      9       5.9856     -0.00000
     10       6.5419     -0.00000
     11       8.0929      0.00000
     12       8.7627      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8746      1.00000
      2      -4.5030      1.00000
      3      -2.5319      1.00000
      4      -1.3913      1.00000
      5      -0.2258      1.00000
      6       0.7457      1.00000
      7       2.1777      1.00307
      8       3.6176     -0.00000
      9       4.8414     -0.00000
     10       7.0342     -0.00000
     11       7.6513     -0.00000
     12       8.5425      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5142      1.00000
      2      -3.1524      1.00000
      3      -3.0071      1.00000
      4      -1.7696      1.00000
      5      -1.0821      1.00000
      6       0.5061      1.00000
      7       1.9118      1.00000
      8       3.3297     -0.00000
      9       4.8333     -0.00000
     10       6.2449     -0.00000
     11       7.9832     -0.00000
     12       8.4850      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4682      1.00000
      2      -9.1115      1.00000
      3      -7.1266      1.00000
      4      -4.2999      1.00000
      5      -1.0072      1.00000
      6       2.9112     -0.03187
      7       5.2725     -0.00000
      8       7.2508     -0.00000
      9       7.4119     -0.00000
     10       9.9069      0.00000
     11       9.9295      0.00000
     12      10.8600      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4682      1.00000
      2      -9.1115      1.00000
      3      -7.1266      1.00000
      4      -4.2999      1.00000
      5      -1.0072      1.00000
      6       2.9112     -0.03187
      7       5.2725     -0.00000
      8       7.2508     -0.00000
      9       7.4119     -0.00000
     10       9.9071      0.00000
     11       9.9295      0.00000
     12      10.8413      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4682      1.00000
      2      -9.1115      1.00000
      3      -7.1266      1.00000
      4      -4.2999      1.00000
      5      -1.0072      1.00000
      6       2.9112     -0.03187
      7       5.2725     -0.00000
      8       7.2508     -0.00000
      9       7.4119     -0.00000
     10       9.9070      0.00000
     11       9.9295      0.00000
     12      10.8437      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9428      1.00000
      2      -8.5841      1.00000
      3      -6.5961      1.00000
      4      -3.7619      1.00000
      5      -0.4818      1.00000
      6       3.3852     -0.00000
      7       5.6840     -0.00000
      8       7.4004     -0.00000
      9       7.6953     -0.00000
     10       8.2743      0.00000
     11       8.9039      0.00000
     12       9.2123      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4296      0.00000
     12       8.5639      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4296      0.00000
     12       8.5639      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4296      0.00000
     12       8.5639      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4296      0.00000
     12       8.5639      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4296      0.00000
     12       8.5639      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2668      1.00000
      2      -7.9053      1.00000
      3      -5.9139      1.00000
      4      -3.0734      1.00000
      5       0.1849      1.00000
      6       3.9165     -0.00000
      7       5.5855     -0.00000
      8       6.4243     -0.00000
      9       6.9229     -0.00000
     10       7.9906     -0.00000
     11       8.4296      0.00000
     12       8.5639      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4395      1.00000
      2      -7.0746      1.00000
      3      -5.0801      1.00000
      4      -2.2395      1.00000
      5       0.9662      1.00000
      6       3.4658     -0.00000
      7       4.7031     -0.00000
      8       5.1983     -0.00000
      9       6.6351     -0.00000
     10       7.0415     -0.00000
     11       7.7390     -0.00000
     12       8.7618      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.2845      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.2845      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.2845      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.2845      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.2845      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4601      1.00000
      2      -6.0915      1.00000
      3      -4.0964      1.00000
      4      -1.2811      1.00000
      5       1.3323      1.00000
      6       2.1828      1.00339
      7       3.1184     -0.00152
      8       4.8871     -0.00000
      9       5.6672     -0.00000
     10       7.0835     -0.00000
     11       7.4751     -0.00000
     12       8.2845      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3278      1.00000
      2      -4.9564      1.00000
      3      -2.9704      1.00000
      4      -0.5471      1.00000
      5      -0.0043      1.00000
      6       1.2865      1.00000
      7       3.0537     -0.00549
      8       3.3033     -0.00001
      9       5.6601     -0.00000
     10       6.5011     -0.00000
     11       7.1608     -0.00000
     12       8.3003      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0426      1.00000
      2      -3.6739      1.00000
      3      -2.0379      1.00000
      4      -1.7600      1.00000
      5      -0.6428      1.00000
      6       1.1239      1.00000
      7       1.7317      1.00000
      8       4.1566     -0.00000
      9       4.3805     -0.00000
     10       6.5598     -0.00000
     11       7.0736     -0.00000
     12       7.8291     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6323      1.00000
      2      -3.5827      1.00000
      3      -2.3002      1.00000
      4      -2.2357      1.00000
      5      -0.5905      1.00000
      6       0.2610      1.00000
      7       2.5596      0.78379
      8       2.9084     -0.03224
      9       5.3771     -0.00000
     10       5.8829     -0.00000
     11       6.6854     -0.00000
     12       7.9017     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6323      1.00000
      2      -3.5827      1.00000
      3      -2.3002      1.00000
      4      -2.2357      1.00000
      5      -0.5905      1.00000
      6       0.2610      1.00000
      7       2.5596      0.78379
      8       2.9084     -0.03224
      9       5.3771     -0.00000
     10       5.8829     -0.00000
     11       6.6854     -0.00000
     12       7.9017     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6323      1.00000
      2      -3.5827      1.00000
      3      -2.3002      1.00000
      4      -2.2357      1.00000
      5      -0.5905      1.00000
      6       0.2610      1.00000
      7       2.5596      0.78379
      8       2.9084     -0.03224
      9       5.3771     -0.00000
     10       5.8829     -0.00000
     11       6.6854     -0.00000
     12       7.9017     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3419      1.00000
      2      -7.9808      1.00000
      3      -5.9897      1.00000
      4      -3.1496      1.00000
      5       0.1125      1.00000
      6       3.8863     -0.00000
      7       6.0318     -0.00000
      8       6.9662     -0.00000
      9       7.0142     -0.00000
     10       8.0596     -0.00000
     11       8.1543      0.00000
     12       8.4105      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3419      1.00000
      2      -7.9808      1.00000
      3      -5.9897      1.00000
      4      -3.1496      1.00000
      5       0.1125      1.00000
      6       3.8863     -0.00000
      7       6.0318     -0.00000
      8       6.9662     -0.00000
      9       7.0142     -0.00000
     10       8.0596     -0.00000
     11       8.1543      0.00000
     12       8.4105      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3419      1.00000
      2      -7.9808      1.00000
      3      -5.9897      1.00000
      4      -3.1496      1.00000
      5       0.1125      1.00000
      6       3.8863     -0.00000
      7       6.0318     -0.00000
      8       6.9662     -0.00000
      9       7.0142     -0.00000
     10       8.0596     -0.00000
     11       8.1543      0.00000
     12       8.4105      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5899      1.00000
      2      -7.2258      1.00000
      3      -5.2317      1.00000
      4      -2.3895      1.00000
      5       0.8377      1.00000
      6       4.2479     -0.00000
      7       5.1039     -0.00000
      8       6.0727     -0.00000
      9       6.3808     -0.00000
     10       7.0139     -0.00000
     11       7.3694     -0.00000
     12       8.0567     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6862      1.00000
      2      -6.3186      1.00000
      3      -4.3230      1.00000
      4      -1.4927      1.00000
      5       1.6077      1.00000
      6       2.9156     -0.03088
      7       4.2224     -0.00000
      8       5.1878     -0.00000
      9       5.9490     -0.00000
     10       6.0675     -0.00000
     11       7.0758     -0.00000
     12       7.7005     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6298      1.00000
      2      -5.2591      1.00000
      3      -3.2677      1.00000
      4      -0.5162      1.00000
      5       0.8871      1.00000
      6       2.2609      1.01263
      7       3.0092     -0.01123
      8       4.2501     -0.00000
      9       5.0943     -0.00000
     10       6.2548     -0.00000
     11       6.6964     -0.00000
     12       7.3734     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70333
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70334
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70333
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70333
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70333
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4202      1.00000
      2      -4.0496      1.00000
      3      -2.0846      1.00000
      4      -0.9431      1.00000
      5       0.2088      1.00000
      6       1.1746      1.00000
      7       2.5815      0.70334
      8       3.9294     -0.00000
      9       4.7617     -0.00000
     10       5.4379     -0.00000
     11       6.4544     -0.00000
     12       7.6774     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0593      1.00000
      2      -2.7020      1.00000
      3      -2.5525      1.00000
      4      -1.3275      1.00000
      5      -0.6401      1.00000
      6       0.9436      1.00000
      7       2.2920      1.01869
      8       3.6035     -0.00000
      9       4.7221     -0.00000
     10       5.4526     -0.00000
     11       6.2297     -0.00000
     12       6.8362     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7615      1.00000
      2      -6.3943      1.00000
      3      -4.3986      1.00000
      4      -1.5646      1.00000
      5       1.5907      1.00000
      6       3.9911     -0.00000
      7       4.2241     -0.00000
      8       5.2794     -0.00000
      9       5.4970     -0.00000
     10       6.0232     -0.00000
     11       7.0952     -0.00000
     12       7.4110     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7615      1.00000
      2      -6.3943      1.00000
      3      -4.3986      1.00000
      4      -1.5646      1.00000
      5       1.5907      1.00000
      6       3.9911     -0.00000
      7       4.2241     -0.00000
      8       5.2794     -0.00000
      9       5.4970     -0.00000
     10       6.0232     -0.00000
     11       7.0952     -0.00000
     12       7.4110     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7615      1.00000
      2      -6.3943      1.00000
      3      -4.3986      1.00000
      4      -1.5646      1.00000
      5       1.5907      1.00000
      6       3.9911     -0.00000
      7       4.2241     -0.00000
      8       5.2794     -0.00000
      9       5.4970     -0.00000
     10       6.0232     -0.00000
     11       7.0952     -0.00000
     12       7.4110     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7807      1.00000
      2      -5.4105      1.00000
      3      -3.4172      1.00000
      4      -0.6226      1.00000
      5       1.9555      1.00001
      6       2.7431      0.09868
      7       3.7047     -0.00000
      8       3.7916     -0.00000
      9       4.8981     -0.00000
     10       5.5634     -0.00000
     11       6.5649     -0.00000
     12       7.0151     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1294     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6467      1.00000
      2      -4.2758      1.00000
      3      -2.2971      1.00000
      4       0.1048      1.00000
      5       0.6416      1.00000
      6       1.9055      1.00000
      7       3.1293     -0.00120
      8       3.6566     -0.00000
      9       4.0430     -0.00000
     10       4.8189     -0.00000
     11       6.3809     -0.00000
     12       6.9125     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3605      1.00000
      2      -2.9958      1.00000
      3      -1.3616      1.00000
      4      -1.0995      1.00000
      5       0.0183      1.00000
      6       1.7260      1.00000
      7       2.2445      1.00985
      8       3.0547     -0.00533
      9       4.3266     -0.00000
     10       5.0815     -0.00000
     11       5.3342     -0.00000
     12       6.5275     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9545      1.00000
      2      -2.8982      1.00000
      3      -1.6204      1.00000
      4      -1.5737      1.00000
      5       0.0516      1.00000
      6       0.9181      1.00000
      7       2.7051      0.20916
      8       2.9530     -0.02265
      9       3.8805     -0.00000
     10       4.7788     -0.00000
     11       6.1613     -0.00000
     12       6.4745     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9545      1.00000
      2      -2.8982      1.00000
      3      -1.6204      1.00000
      4      -1.5737      1.00000
      5       0.0516      1.00000
      6       0.9181      1.00000
      7       2.7051      0.20917
      8       2.9530     -0.02265
      9       3.8805     -0.00000
     10       4.7788     -0.00000
     11       6.1613     -0.00000
     12       6.4745     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9545      1.00000
      2      -2.8982      1.00000
      3      -1.6204      1.00000
      4      -1.5737      1.00000
      5       0.0516      1.00000
      6       0.9181      1.00000
      7       2.7051      0.20916
      8       2.9530     -0.02265
      9       3.8805     -0.00000
     10       4.7788     -0.00000
     11       6.1613     -0.00000
     12       6.4745     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7223      1.00000
      2      -4.3513      1.00000
      3      -2.3693      1.00000
      4       0.3008      1.00000
      5       1.5998      1.00000
      6       1.9004      1.00000
      7       3.0115     -0.01080
      8       3.2950     -0.00001
      9       4.0220     -0.00000
     10       4.8025     -0.00000
     11       5.6215     -0.00000
     12       7.2690     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7223      1.00000
      2      -4.3513      1.00000
      3      -2.3693      1.00000
      4       0.3008      1.00000
      5       1.5998      1.00000
      6       1.9004      1.00000
      7       3.0115     -0.01080
      8       3.2950     -0.00001
      9       4.0220     -0.00000
     10       4.8025     -0.00000
     11       5.6215     -0.00000
     12       7.2690     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7223      1.00000
      2      -4.3513      1.00000
      3      -2.3693      1.00000
      4       0.3008      1.00000
      5       1.5998      1.00000
      6       1.9004      1.00000
      7       3.0115     -0.01080
      8       3.2950     -0.00001
      9       4.0220     -0.00000
     10       4.8025     -0.00000
     11       5.6215     -0.00000
     12       7.2690     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5112      1.00000
      2      -3.1445      1.00000
      3      -1.2020      1.00000
      4      -0.0529      1.00000
      5       1.0087      1.00000
      6       1.3658      1.00000
      7       2.0512      1.00016
      8       2.7975      0.00161
      9       3.6828     -0.00000
     10       4.9233     -0.00000
     11       5.0857     -0.00000
     12       6.3163     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1512      1.00000
      2      -1.8065      1.00000
      3      -1.6471      1.00000
      4      -0.4520      1.00000
      5       0.2173      1.00000
      6       1.2552      1.00000
      7       1.7516      1.00000
      8       2.3602      1.03336
      9       3.6860     -0.00000
     10       4.6200     -0.00000
     11       5.1515     -0.00000
     12       6.1522     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2258      1.00000
      2      -1.8745      1.00000
      3      -0.2767      1.00000
      4      -0.2161      1.00000
      5      -0.0656      1.00000
      6       0.9378      1.00000
      7       1.2670      1.00000
      8       2.4763      0.98298
      9       3.6846     -0.00000
     10       3.8175     -0.00000
     11       5.9762     -0.00000
     12       6.2183     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2258      1.00000
      2      -1.8745      1.00000
      3      -0.2767      1.00000
      4      -0.2161      1.00000
      5      -0.0656      1.00000
      6       0.9378      1.00000
      7       1.2670      1.00000
      8       2.4763      0.98298
      9       3.6846     -0.00000
     10       3.8175     -0.00000
     11       5.9763     -0.00000
     12       6.2192     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2258      1.00000
      2      -1.8745      1.00000
      3      -0.2767      1.00000
      4      -0.2161      1.00000
      5      -0.0656      1.00000
      6       0.9378      1.00000
      7       1.2670      1.00000
      8       2.4763      0.98298
      9       3.6846     -0.00000
     10       3.8175     -0.00000
     11       5.9757     -0.00000
     12       6.2175     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8308      1.00000
      2      -1.7650      1.00000
      3      -0.5128      1.00000
      4      -0.4873      1.00000
      5      -0.3059      1.00000
      6       0.7187      1.00000
      7       1.4326      1.00000
      8       1.7836      1.00000
      9       3.4576     -0.00000
     10       4.5823     -0.00000
     11       4.8561     -0.00000
     12       6.0302     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8308      1.00000
      2      -1.7650      1.00000
      3      -0.5128      1.00000
      4      -0.4873      1.00000
      5      -0.3059      1.00000
      6       0.7187      1.00000
      7       1.4326      1.00000
      8       1.7836      1.00000
      9       3.4576     -0.00000
     10       4.5823     -0.00000
     11       4.8561     -0.00000
     12       6.0302     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8308      1.00000
      2      -1.7650      1.00000
      3      -0.5128      1.00000
      4      -0.4873      1.00000
      5      -0.3059      1.00000
      6       0.7187      1.00000
      7       1.4326      1.00000
      8       1.7836      1.00000
      9       3.4576     -0.00000
     10       4.5823     -0.00000
     11       4.8561     -0.00000
     12       6.0302     -0.00000


--------------------------------------------------------------------------------------------------------


 soft charge-density along one line, spin component           1
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 soft charge-density along one line, spin component           2
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 pseudopotential strength for first ion, spin component:           1
  8.085  13.802   0.000  -0.002   0.000   0.000  -0.006   0.000
 13.802  23.556   0.000  -0.003   0.000   0.000  -0.010   0.000
  0.000   0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880  -0.000  -0.000   5.472  -0.000
  0.000   0.000   0.000  -0.000   1.879   0.000  -0.000   5.469
  0.000   0.000   5.469  -0.000   0.000  15.775  -0.000   0.000
 -0.006  -0.010  -0.000   5.472  -0.000  -0.000  15.783  -0.000
  0.000   0.000   0.000  -0.000   5.469   0.000  -0.000  15.775
 pseudopotential strength for first ion, spin component:           2
  8.085  13.802   0.000  -0.002   0.000  -0.000  -0.006   0.000
 13.802  23.556   0.000  -0.003   0.000  -0.000  -0.010   0.000
  0.000   0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880  -0.000  -0.000   5.472  -0.000
  0.000   0.000   0.000  -0.000   1.879   0.000  -0.000   5.469
 -0.000  -0.000   5.469  -0.000   0.000  15.775  -0.000   0.000
 -0.006  -0.010  -0.000   5.472  -0.000  -0.000  15.783  -0.000
  0.000   0.000   0.000  -0.000   5.469   0.000  -0.000  15.775
 total augmentation occupancy for first ion, spin component:           1
116.848 -62.405  -0.000  -0.170  -0.000   0.000  -0.009   0.000
-62.405  33.328   0.000   0.081   0.000  -0.000   0.006  -0.000
 -0.000   0.000   2.104  -0.000  -0.000  -0.326  -0.000   0.000
 -0.170   0.081  -0.000   1.665   0.000  -0.000  -0.256  -0.000
 -0.000   0.000  -0.000   0.000   2.104   0.000  -0.000  -0.326
  0.000  -0.000  -0.326  -0.000   0.000   0.051   0.000  -0.000
 -0.009   0.006  -0.000  -0.256  -0.000   0.000   0.039   0.000
  0.000  -0.000   0.000  -0.000  -0.326  -0.000   0.000   0.051
 total augmentation occupancy for first ion, spin component:           2
 -0.000   0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000
  0.000  -0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000
  0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000  -0.000
  0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000  -0.000
  0.000  -0.000   0.000   0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000  -0.000  -0.000   0.000   0.000   0.000  -0.000


------------------------ aborting loop because EDIFF is reached ----------------------------------------


    FORLOC:  cpu time      0.0008: real time      0.0008
    FORHF :  cpu time   1052.9279: real time   1057.1565
    FORNL :  cpu time      0.2598: real time      0.2613
    FORCOR:  cpu time      1.1759: real time      1.1792
    OFIELD:  cpu time      0.0001: real time      0.0001

 VOLUME and BASIS-vectors are now :
 -----------------------------------------------------------------------------
  energy-cutoff  :      400.00
  volume of cell :      120.20
      direct lattice vectors                 reciprocal lattice vectors
     2.857459769  0.000000000  0.000000000     0.349961183 -0.202050183  0.000000000
     1.428729885  2.474632750  0.000000000     0.000000000  0.404100366  0.000000000
     0.000000000  0.000000000 16.999318395     0.000000000  0.000000000  0.058825888

  length of vectors
     2.857459769  2.857459769 16.999318395     0.404100366  0.404100366  0.058825888


 FORCES acting on ions:
    Electron-Ion                     Ewald-Force                    Non-Local-Force
 -----------------------------------------------------------------------------------------------
   -.657E-06 0.659E-07 0.156E+03   0.410E-13 0.246E-13 -.155E+03   0.638E-06 -.142E-06 -.113E+01
   -.883E-06 -.693E-06 0.520E+02   -.137E-12 -.791E-13 -.520E+02   0.107E-05 0.736E-06 0.104E+00
   -.780E-06 0.480E-06 -.532E+02   0.136E-12 0.811E-13 0.531E+02   0.680E-06 -.749E-06 0.122E+00
   -.903E-06 0.122E-05 -.155E+03   -.389E-13 -.218E-13 0.154E+03   0.922E-06 -.165E-05 0.904E+00
 -----------------------------------------------------------------------------------------------
   -.278E-05 0.151E-05 -.159E-02   0.721E-15 0.484E-14 -.284E-13   0.331E-05 -.181E-05 0.407E-02
 
 
 POSITION                                       TOTAL-FORCE (eV/Angst)
 -----------------------------------------------------------------------------------
      0.00000      0.00000      0.00000        -0.000000     -0.000000     -0.104027
      1.42873      0.82488      2.33311        -0.000000      0.000000      0.105907
      2.85746      1.64976      4.63978         0.000000      0.000000     -0.005036
      0.00000      0.00000      7.01464         0.000000     -0.000000      0.003157
 -----------------------------------------------------------------------------------
    total drift:                                0.000001     -0.000000      0.003256


--------------------------------------------------------------------------------------------------------



  FREE ENERGIE OF THE ION-ELECTRON SYSTEM (eV)
  ---------------------------------------------------
  free  energy   TOTEN  =       -10.94946476 eV

  energy  without entropy=      -10.94979441  energy(sigma->0) =      -10.94957464
 
 d Force = 0.7726233E-05[ 0.654E-05, 0.891E-05]  d Energy = 0.1039996E-04-0.267E-05
 d Force = 0.2731555E-01[ 0.273E-01, 0.273E-01]  d Ewald  = 0.2731555E-01-0.929E-09


--------------------------------------------------------------------------------------------------------


    POTLOK:  cpu time      1.1746: real time      1.1780


--------------------------------------------------------------------------------------------------------


 Quasi-Newton relaxation of ions (Broydens 2nd method)
  g(Force)  = 0.170E-05   g(Stress)= 0.000E+00

 retain information from N=  1 steps
 eigenvalues of (default step * inverse Hessian matrix)
  average eigenvalue of G=   8.9392
 eigenvalue spectrum of G is  8.9392


--------------------------------------------------------------------------------------------------------


    WAVPRE:  cpu time      0.0036: real time      0.0984
    FEWALD:  cpu time      0.0002: real time      0.0002
    ORTHCH:  cpu time      0.0931: real time      0.0934
    POTLOK:  cpu time      1.1752: real time      1.1786
    EDDIAG:  cpu time   1296.4599: real time   1301.7528
    CHARGE:  cpu time      0.2431: real time      0.2441
 writing wavefunctions
     LOOP+:  cpu time   8827.9977: real time   8864.2189


--------------------------------------- Iteration      5(   1)  ---------------------------------------


    POTLOK:  cpu time      0.4079: real time      0.4094
    SETDIJ:  cpu time      0.7906: real time      0.7926
    TRIAL :  cpu time   1287.8145: real time   1293.0393
    CORREC:  cpu time      0.0063: real time      0.0063
    CHARGE:  cpu time      0.2421: real time      0.2431
    --------------------------------------------
      LOOP:  cpu time   1289.2717: real time   1294.5013

 eigenvalue-minimisations  :     0
 total energy-change (2. order) : 0.2144779E-03  (-0.2138903E-03)
 number of electron      12.0000000 magnetization      -0.0000001
 augmentation part       -0.0019001 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.54031363
  -Hartree energ DENC   =      -508.03056105
  -exchange      EXHF   =        26.47788835
  -V(xc)+E(xc)   XCENC  =       -66.89583751
  PAW double counting   =     82042.13073370   -81961.36709229
  entropy T*S    EENTRO =         0.00035743
  eigenvalues    EBANDS =       -34.71447417
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94924464 eV

  energy without entropy =      -10.94960207  energy(sigma->0) =      -10.94936378
  exchange ACFDT corr.  =        -0.00054080  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      5(   2)  ---------------------------------------


    POTLOK:  cpu time      0.3881: real time      0.3896
    SETDIJ:  cpu time      0.7897: real time      0.7917
    TRIAL :  cpu time   1289.6378: real time   1295.0031
    CORREC:  cpu time      0.0061: real time      0.0062
    CHARGE:  cpu time      0.2428: real time      0.2438
    --------------------------------------------
      LOOP:  cpu time   1291.0650: real time   1296.4348

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1014109E-03  (-0.7687894E-04)
 number of electron      12.0000000 magnetization      -0.0000001
 augmentation part       -0.0018967 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.54031363
  -Hartree energ DENC   =      -507.98062506
  -exchange      EXHF   =        26.47738587
  -V(xc)+E(xc)   XCENC  =       -66.89603386
  PAW double counting   =     82044.70287858   -81963.93920132
  entropy T*S    EENTRO =         0.00036349
  eigenvalues    EBANDS =       -34.76385449
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94934605 eV

  energy without entropy =      -10.94970955  energy(sigma->0) =      -10.94946722
  exchange ACFDT corr.  =        -0.00053787  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      5(   3)  ---------------------------------------


    POTLOK:  cpu time      0.3862: real time      0.3876
    SETDIJ:  cpu time      0.7895: real time      0.7915
    TRIAL :  cpu time   1293.8201: real time   1299.0661
    CORREC:  cpu time      0.0065: real time      0.0065
    CHARGE:  cpu time      0.2434: real time      0.2444
    --------------------------------------------
      LOOP:  cpu time   1295.2462: real time   1300.4966

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.5576258E-04  (-0.5978284E-04)
 number of electron      12.0000000 magnetization      -0.0000000
 augmentation part       -0.0018953 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.54031363
  -Hartree energ DENC   =      -507.93341327
  -exchange      EXHF   =        26.47688794
  -V(xc)+E(xc)   XCENC  =       -66.89623187
  PAW double counting   =     82048.52058165   -81967.75690865
  entropy T*S    EENTRO =         0.00036646
  eigenvalues    EBANDS =       -34.81042790
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94940181 eV

  energy without entropy =      -10.94976827  energy(sigma->0) =      -10.94952397
  exchange ACFDT corr.  =        -0.00053521  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      5(   4)  ---------------------------------------


    POTLOK:  cpu time      0.3869: real time      0.3883
    SETDIJ:  cpu time      0.7894: real time      0.7914
    TRIAL :  cpu time   1292.6434: real time   1297.9164
    CORREC:  cpu time      0.0066: real time      0.0066
    CHARGE:  cpu time      0.2439: real time      0.2449
    --------------------------------------------
      LOOP:  cpu time   1294.0704: real time   1299.3479

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.2569873E-04  (-0.1911000E-04)
 number of electron      12.0000000 magnetization      -0.0000000
 augmentation part       -0.0018949 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.54031363
  -Hartree energ DENC   =      -507.91717736
  -exchange      EXHF   =        26.47672090
  -V(xc)+E(xc)   XCENC  =       -66.89631280
  PAW double counting   =     82052.18668276   -81971.42300880
  entropy T*S    EENTRO =         0.00036615
  eigenvalues    EBANDS =       -34.82644547
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94942751 eV

  energy without entropy =      -10.94979366  energy(sigma->0) =      -10.94954956
  exchange ACFDT corr.  =        -0.00053403  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      5(   5)  ---------------------------------------


    POTLOK:  cpu time      0.3864: real time      0.3878
    SETDIJ:  cpu time      0.7936: real time      0.7957
    TRIAL :  cpu time   1291.9108: real time   1297.1303
    CORREC:  cpu time      0.0066: real time      0.0066
    CHARGE:  cpu time      0.2425: real time      0.2435
    --------------------------------------------
      LOOP:  cpu time   1293.3405: real time   1298.5645

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1524201E-04  (-0.1875248E-04)
 number of electron      12.0000000 magnetization      -0.0000000
 augmentation part       -0.0018947 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.54031363
  -Hartree energ DENC   =      -507.92512057
  -exchange      EXHF   =        26.47683760
  -V(xc)+E(xc)   XCENC  =       -66.89628925
  PAW double counting   =     82055.65264010   -81974.88897493
  entropy T*S    EENTRO =         0.00036421
  eigenvalues    EBANDS =       -34.81864864
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94944276 eV

  energy without entropy =      -10.94980697  energy(sigma->0) =      -10.94956416
  exchange ACFDT corr.  =        -0.00053427  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      5(   6)  ---------------------------------------


    POTLOK:  cpu time      0.3882: real time      0.3897
    SETDIJ:  cpu time      0.7920: real time      0.7940
    TRIAL :  cpu time   1288.2003: real time   1293.5076
    CORREC:  cpu time      0.0068: real time      0.0068
    EDDIAG:  cpu time   1292.9192: real time   1298.1812
    CHARGE:  cpu time      0.2428: real time      0.2439
    --------------------------------------------
      LOOP:  cpu time   2582.5500: real time   2593.1241

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.9886906E-05  (-0.7714100E-05)
 number of electron      12.0000000 magnetization       0.0000000
 augmentation part       -0.0018942 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.54031363
  -Hartree energ DENC   =      -507.93783107
  -exchange      EXHF   =        26.47716514
  -V(xc)+E(xc)   XCENC  =       -66.89623125
  PAW double counting   =     82059.01198469   -81978.24836079
  entropy T*S    EENTRO =         0.00036215
  eigenvalues    EBANDS =       -34.80615612
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94945264 eV

  energy without entropy =      -10.94981479  energy(sigma->0) =      -10.94957336
  exchange ACFDT corr.  =        -0.00053520  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------


  average scaling for gradient   0.8953


 average (electrostatic) potential at core
  the test charge radii are     1.0406
  (the norm of the test charge is              1.0000)
       1 -70.4224       2 -70.3834       3 -70.3997       4 -70.4545
 
 
 
 E-fermi :   2.6320     XC(G=0):  -4.7790     alpha+bet : -8.1680

 Fermi energy:         2.6320158240

 spin component 1

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3672      1.00000
      2     -10.0095      1.00000
      3      -8.0369      1.00000
      4      -5.2257      1.00000
      5      -1.9155      1.00000
      6       2.0384      1.00011
      7       4.5135     -0.00000
      8       6.5232     -0.00000
      9       6.7127     -0.00000
     10      10.8414      0.00000
     11      10.8647      0.00000
     12      15.5344      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2922      1.00000
      2      -9.9343      1.00000
      3      -7.9611      1.00000
      4      -5.1483      1.00000
      5      -1.8395      1.00000
      6       2.1140      1.00077
      7       4.5779     -0.00000
      8       6.5859     -0.00000
      9       6.7741     -0.00000
     10      10.8887      0.00000
     11      10.9203      0.00000
     12      13.9329      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2922      1.00000
      2      -9.9343      1.00000
      3      -7.9611      1.00000
      4      -5.1483      1.00000
      5      -1.8395      1.00000
      6       2.1140      1.00077
      7       4.5779     -0.00000
      8       6.5859     -0.00000
      9       6.7741     -0.00000
     10      10.8887      0.00000
     11      10.9203      0.00000
     12      13.9329      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2922      1.00000
      2      -9.9343      1.00000
      3      -7.9611      1.00000
      4      -5.1483      1.00000
      5      -1.8395      1.00000
      6       2.1140      1.00077
      7       4.5779     -0.00000
      8       6.5859     -0.00000
      9       6.7741     -0.00000
     10      10.8887      0.00000
     11      10.9203      0.00000
     12      13.9329      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0672      1.00000
      2      -9.7085      1.00000
      3      -7.7339      1.00000
      4      -4.9164      1.00000
      5      -1.6116      1.00000
      6       2.3377      1.02894
      7       4.7696     -0.00000
      8       6.7724     -0.00000
      9       6.9558     -0.00000
     10      10.9734      0.00000
     11      11.0804      0.00000
     12      11.9669      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0672      1.00000
      2      -9.7085      1.00000
      3      -7.7339      1.00000
      4      -4.9164      1.00000
      5      -1.6116      1.00000
      6       2.3377      1.02894
      7       4.7696     -0.00000
      8       6.7724     -0.00000
      9       6.9558     -0.00000
     10      10.9734      0.00000
     11      11.0804      0.00000
     12      11.9669      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0672      1.00000
      2      -9.7085      1.00000
      3      -7.7339      1.00000
      4      -4.9164      1.00000
      5      -1.6116      1.00000
      6       2.3377      1.02894
      7       4.7696     -0.00000
      8       6.7724     -0.00000
      9       6.9558     -0.00000
     10      10.9734      0.00000
     11      11.0804      0.00000
     12      11.9669      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3320      1.00000
      3      -7.3551      1.00000
      4      -4.5306      1.00000
      5      -1.2331      1.00000
      6       2.6996      0.23037
      7       5.0842     -0.00000
      8       7.0723     -0.00000
      9       7.2451     -0.00000
     10       9.7565      0.00000
     11      10.6881      0.00000
     12      12.1803      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3320      1.00000
      3      -7.3551      1.00000
      4      -4.5306      1.00000
      5      -1.2331      1.00000
      6       2.6996      0.23037
      7       5.0842     -0.00000
      8       7.0723     -0.00000
      9       7.2451     -0.00000
     10       9.7565      0.00000
     11      10.6881      0.00000
     12      11.8114      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3320      1.00000
      3      -7.3551      1.00000
      4      -4.5306      1.00000
      5      -1.2331      1.00000
      6       2.6996      0.23037
      7       5.0842     -0.00000
      8       7.0723     -0.00000
      9       7.2451     -0.00000
     10       9.7565      0.00000
     11      10.6881      0.00000
     12      11.6251      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1669      1.00000
      2      -8.8047      1.00000
      3      -6.8248      1.00000
      4      -3.9919      1.00000
      5      -0.7063      1.00000
      6       3.1825     -0.00035
      7       5.5021     -0.00000
      8       7.2075     -0.00000
      9       7.5859     -0.00000
     10       8.1068      0.00000
     11       8.7611      0.00000
     12      10.4265      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1669      1.00000
      2      -8.8047      1.00000
      3      -6.8248      1.00000
      4      -3.9919      1.00000
      5      -0.7063      1.00000
      6       3.1825     -0.00035
      7       5.5021     -0.00000
      8       7.2075     -0.00000
      9       7.5859     -0.00000
     10       8.1068      0.00000
     11       8.7611      0.00000
     12      10.4265      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1669      1.00000
      2      -8.8047      1.00000
      3      -6.8248      1.00000
      4      -3.9919      1.00000
      5      -0.7063      1.00000
      6       3.1825     -0.00035
      7       5.5021     -0.00000
      8       7.2075     -0.00000
      9       7.5859     -0.00000
     10       8.1068      0.00000
     11       8.7611      0.00000
     12      10.4265      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1261      1.00000
      3      -6.1426      1.00000
      4      -3.3022      1.00000
      5      -0.0372      1.00000
      6       3.7222     -0.00000
      7       5.3970     -0.00000
      8       6.2514     -0.00000
      9       6.7471     -0.00000
     10       8.1006      0.00000
     11       8.2405      0.00000
     12       8.6120      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1261      1.00000
      3      -6.1426      1.00000
      4      -3.3022      1.00000
      5      -0.0372      1.00000
      6       3.7222     -0.00000
      7       5.3970     -0.00000
      8       6.2514     -0.00000
      9       6.7471     -0.00000
     10       8.1006      0.00000
     11       8.2405      0.00000
     12       8.6120      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1261      1.00000
      3      -6.1426      1.00000
      4      -3.3022      1.00000
      5      -0.0372      1.00000
      6       3.7222     -0.00000
      7       5.3970     -0.00000
      8       6.2514     -0.00000
      9       6.7471     -0.00000
     10       8.1006      0.00000
     11       8.2405      0.00000
     12       8.6120      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6641      1.00000
      2      -7.2957      1.00000
      3      -5.3087      1.00000
      4      -2.4663      1.00000
      5       0.7481      1.00000
      6       3.2540     -0.00005
      7       4.5153     -0.00000
      8       5.0348     -0.00000
      9       6.4607     -0.00000
     10       6.9460     -0.00000
     11       8.7829      0.00000
     12      10.4856      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6641      1.00000
      2      -7.2957      1.00000
      3      -5.3087      1.00000
      4      -2.4663      1.00000
      5       0.7481      1.00000
      6       3.2540     -0.00005
      7       4.5153     -0.00000
      8       5.0348     -0.00000
      9       6.4607     -0.00000
     10       6.9460     -0.00000
     11       8.7823      0.00000
     12      10.3840      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6641      1.00000
      2      -7.2957      1.00000
      3      -5.3087      1.00000
      4      -2.4663      1.00000
      5       0.7481      1.00000
      6       3.2540     -0.00005
      7       4.5153     -0.00000
      8       5.0348     -0.00000
      9       6.4607     -0.00000
     10       6.9460     -0.00000
     11       8.7833      0.00000
     12      10.6586      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6853      1.00000
      2      -6.3128      1.00000
      3      -4.3245      1.00000
      4      -1.5040      1.00000
      5       1.1152      1.00000
      6       1.9690      1.00001
      7       2.9143     -0.03107
      8       4.6951     -0.00000
      9       5.5687     -0.00000
     10       7.2789     -0.00000
     11       7.6738     -0.00000
     12      10.2757      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6853      1.00000
      2      -6.3128      1.00000
      3      -4.3245      1.00000
      4      -1.5040      1.00000
      5       1.1152      1.00000
      6       1.9690      1.00001
      7       2.9143     -0.03107
      8       4.6951     -0.00000
      9       5.5687     -0.00000
     10       7.2789     -0.00000
     11       7.6738     -0.00000
     12      10.2778      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6853      1.00000
      2      -6.3128      1.00000
      3      -4.3245      1.00000
      4      -1.5040      1.00000
      5       1.1152      1.00000
      6       1.9690      1.00001
      7       2.9143     -0.03107
      8       4.6951     -0.00000
      9       5.5687     -0.00000
     10       7.2789     -0.00000
     11       7.6738     -0.00000
     12      10.2785      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5536      1.00000
      2      -5.1777      1.00000
      3      -3.1971      1.00000
      4      -0.7651      1.00000
      5      -0.2257      1.00000
      6       1.0720      1.00000
      7       2.8553     -0.03346
      8       3.0974     -0.00240
      9       5.5783     -0.00000
     10       6.5514     -0.00000
     11       8.3008      0.00000
     12       9.8284      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5536      1.00000
      2      -5.1777      1.00000
      3      -3.1971      1.00000
      4      -0.7651      1.00000
      5      -0.2257      1.00000
      6       1.0720      1.00000
      7       2.8553     -0.03346
      8       3.0974     -0.00240
      9       5.5783     -0.00000
     10       6.5514     -0.00000
     11       8.3008      0.00000
     12       9.8228      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5536      1.00000
      2      -5.1777      1.00000
      3      -3.1971      1.00000
      4      -0.7651      1.00000
      5      -0.2257      1.00000
      6       1.0720      1.00000
      7       2.8553     -0.03346
      8       3.0974     -0.00240
      9       5.5783     -0.00000
     10       6.5514     -0.00000
     11       8.3008      0.00000
     12       9.7303      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2689      1.00000
      2      -3.8946      1.00000
      3      -2.2633      1.00000
      4      -1.9823      1.00000
      5      -0.8598      1.00000
      6       0.9068      1.00000
      7       1.5230      1.00000
      8       4.0020     -0.00000
      9       4.1920     -0.00000
     10       6.8818     -0.00000
     11       7.6005     -0.00000
     12       9.8006      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2689      1.00000
      2      -3.8946      1.00000
      3      -2.2633      1.00000
      4      -1.9823      1.00000
      5      -0.8598      1.00000
      6       0.9068      1.00000
      7       1.5230      1.00000
      8       4.0020     -0.00000
      9       4.1920     -0.00000
     10       6.8818     -0.00000
     11       7.6005     -0.00000
     12       9.8006      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2689      1.00000
      2      -3.8946      1.00000
      3      -2.2633      1.00000
      4      -1.9823      1.00000
      5      -0.8598      1.00000
      6       0.9068      1.00000
      7       1.5230      1.00000
      8       4.0020     -0.00000
      9       4.1920     -0.00000
     10       6.8818     -0.00000
     11       7.6005     -0.00000
     12       9.8006      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8569      1.00000
      2      -3.8110      1.00000
      3      -2.5218      1.00000
      4      -2.4516      1.00000
      5      -0.8078      1.00000
      6       0.0337      1.00000
      7       2.3632      1.03363
      8       2.7224      0.15582
      9       5.2682     -0.00000
     10       5.7027     -0.00000
     11       8.4671      0.00000
     12       9.1357      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8569      1.00000
      2      -3.8110      1.00000
      3      -2.5218      1.00000
      4      -2.4516      1.00000
      5      -0.8078      1.00000
      6       0.0337      1.00000
      7       2.3632      1.03363
      8       2.7224      0.15583
      9       5.2682     -0.00000
     10       5.7027     -0.00000
     11       8.4671      0.00000
     12       9.6548      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8569      1.00000
      2      -3.8110      1.00000
      3      -2.5218      1.00000
      4      -2.4516      1.00000
      5      -0.8078      1.00000
      6       0.0337      1.00000
      7       2.3632      1.03363
      8       2.7224      0.15582
      9       5.2682     -0.00000
     10       5.7027     -0.00000
     11       8.4671      0.00000
     12       9.6538      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1422      1.00000
      2      -9.7837      1.00000
      3      -7.8096      1.00000
      4      -4.9936      1.00000
      5      -1.6875      1.00000
      6       2.2637      1.01292
      7       4.7059     -0.00000
      8       6.7106     -0.00000
      9       6.8957     -0.00000
     10      10.9708      0.00000
     11      11.0253      0.00000
     12      12.9520      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1422      1.00000
      2      -9.7837      1.00000
      3      -7.8096      1.00000
      4      -4.9936      1.00000
      5      -1.6875      1.00000
      6       2.2637      1.01292
      7       4.7059     -0.00000
      8       6.7106     -0.00000
      9       6.8957     -0.00000
     10      10.9708      0.00000
     11      11.0253      0.00000
     12      12.9371      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1422      1.00000
      2      -9.7837      1.00000
      3      -7.8096      1.00000
      4      -4.9936      1.00000
      5      -1.6875      1.00000
      6       2.2637      1.01292
      7       4.7059     -0.00000
      8       6.7106     -0.00000
      9       6.8957     -0.00000
     10      10.9708      0.00000
     11      11.0253      0.00000
     12      12.9383      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1758      0.00000
     12      11.4550      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1758      0.00000
     12      11.4549      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1758      0.00000
     12      11.4550      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1758      0.00000
     12      11.4550      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1758      0.00000
     12      11.4549      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1758      0.00000
     12      11.4550      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0840      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0838      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0839      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0838      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0840      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0840      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58055
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58055
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58055
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58055
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58055
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58055
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1061      1.00000
      3      -7.1279      1.00000
      4      -4.2995      1.00000
      5      -1.0067      1.00000
      6       2.9114     -0.03184
      7       5.2704     -0.00000
      8       7.2502     -0.00000
      9       7.4099     -0.00000
     10       9.9067      0.00000
     11       9.9308      0.00000
     12      10.8646      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1061      1.00000
      3      -7.1279      1.00000
      4      -4.2995      1.00000
      5      -1.0067      1.00000
      6       2.9114     -0.03184
      7       5.2704     -0.00000
      8       7.2502     -0.00000
      9       7.4099     -0.00000
     10       9.9066      0.00000
     11       9.9309      0.00000
     12      10.8767      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1061      1.00000
      3      -7.1279      1.00000
      4      -4.2995      1.00000
      5      -1.0067      1.00000
      6       2.9114     -0.03185
      7       5.2704     -0.00000
      8       7.2502     -0.00000
      9       7.4099     -0.00000
     10       9.9066      0.00000
     11       9.9310      0.00000
     12      10.9005      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4186      0.00000
     12       8.5539      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4186      0.00000
     12       8.5539      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4186      0.00000
     12       8.5539      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4186      0.00000
     12       8.5539      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4186      0.00000
     12       8.5539      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4186      0.00000
     12       8.5539      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2772      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2772      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2772      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2772      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2772      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2772      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5823      1.00000
      3      -2.2941      1.00000
      4      -2.2305      1.00000
      5      -0.5915      1.00000
      6       0.2592      1.00000
      7       2.5602      0.78244
      8       2.9086     -0.03229
      9       5.3779     -0.00000
     10       5.8832     -0.00000
     11       6.6861     -0.00000
     12       7.9062     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5823      1.00000
      3      -2.2941      1.00000
      4      -2.2305      1.00000
      5      -0.5915      1.00000
      6       0.2592      1.00000
      7       2.5602      0.78245
      8       2.9086     -0.03229
      9       5.3779     -0.00000
     10       5.8832     -0.00000
     11       6.6861     -0.00000
     12       7.9062     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5823      1.00000
      3      -2.2941      1.00000
      4      -2.2305      1.00000
      5      -0.5915      1.00000
      6       0.2592      1.00000
      7       2.5602      0.78245
      8       2.9086     -0.03229
      9       5.3779     -0.00000
     10       5.8832     -0.00000
     11       6.6861     -0.00000
     12       7.9062     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -7.9753      1.00000
      3      -5.9911      1.00000
      4      -3.1492      1.00000
      5       0.1130      1.00000
      6       3.8865     -0.00000
      7       6.0309     -0.00000
      8       6.9659     -0.00000
      9       7.0148     -0.00000
     10       8.0641     -0.00000
     11       8.1594      0.00000
     12       8.4118      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -7.9753      1.00000
      3      -5.9911      1.00000
      4      -3.1492      1.00000
      5       0.1130      1.00000
      6       3.8865     -0.00000
      7       6.0309     -0.00000
      8       6.9659     -0.00000
      9       7.0148     -0.00000
     10       8.0641     -0.00000
     11       8.1594      0.00000
     12       8.4118      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -7.9753      1.00000
      3      -5.9911      1.00000
      4      -3.1492      1.00000
      5       0.1130      1.00000
      6       3.8865     -0.00000
      7       6.0309     -0.00000
      8       6.9659     -0.00000
      9       7.0148     -0.00000
     10       8.0641     -0.00000
     11       8.1594      0.00000
     12       8.4118      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70794
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70795
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70794
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70794
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70794
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70795
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7604      1.00000
      2      -6.3887      1.00000
      3      -4.3999      1.00000
      4      -1.5643      1.00000
      5       1.5912      1.00000
      6       3.9911     -0.00000
      7       4.2255     -0.00000
      8       5.2833     -0.00000
      9       5.5021     -0.00000
     10       6.0253     -0.00000
     11       7.0946     -0.00000
     12       7.4085     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7604      1.00000
      2      -6.3887      1.00000
      3      -4.3999      1.00000
      4      -1.5643      1.00000
      5       1.5912      1.00000
      6       3.9911     -0.00000
      7       4.2255     -0.00000
      8       5.2833     -0.00000
      9       5.5021     -0.00000
     10       6.0253     -0.00000
     11       7.0946     -0.00000
     12       7.4085     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7604      1.00000
      2      -6.3887      1.00000
      3      -4.3999      1.00000
      4      -1.5643      1.00000
      5       1.5912      1.00000
      6       3.9911     -0.00000
      7       4.2255     -0.00000
      8       5.2833     -0.00000
      9       5.5021     -0.00000
     10       6.0253     -0.00000
     11       7.0946     -0.00000
     12       7.4085     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9529      1.00000
      2      -2.8978      1.00000
      3      -1.6143      1.00000
      4      -1.5683      1.00000
      5       0.0507      1.00000
      6       0.9163      1.00000
      7       2.7055      0.21266
      8       2.9548     -0.02224
      9       3.8814     -0.00000
     10       4.7823     -0.00000
     11       6.1620     -0.00000
     12       6.4725     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9529      1.00000
      2      -2.8978      1.00000
      3      -1.6143      1.00000
      4      -1.5683      1.00000
      5       0.0507      1.00000
      6       0.9163      1.00000
      7       2.7055      0.21266
      8       2.9548     -0.02224
      9       3.8814     -0.00000
     10       4.7823     -0.00000
     11       6.1621     -0.00000
     12       6.4725     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9529      1.00000
      2      -2.8978      1.00000
      3      -1.6143      1.00000
      4      -1.5683      1.00000
      5       0.0507      1.00000
      6       0.9163      1.00000
      7       2.7055      0.21266
      8       2.9548     -0.02224
      9       3.8814     -0.00000
     10       4.7823     -0.00000
     11       6.1620     -0.00000
     12       6.4725     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3456      1.00000
      3      -2.3706      1.00000
      4       0.3013      1.00000
      5       1.6014      1.00000
      6       1.9010      1.00000
      7       3.0156     -0.01015
      8       3.3003     -0.00001
      9       4.0233     -0.00000
     10       4.8016     -0.00000
     11       5.6197     -0.00000
     12       7.2697     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3456      1.00000
      3      -2.3706      1.00000
      4       0.3013      1.00000
      5       1.6014      1.00000
      6       1.9010      1.00000
      7       3.0156     -0.01015
      8       3.3003     -0.00001
      9       4.0233     -0.00000
     10       4.8016     -0.00000
     11       5.6197     -0.00000
     12       7.2697     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3456      1.00000
      3      -2.3706      1.00000
      4       0.3013      1.00000
      5       1.6014      1.00000
      6       1.9010      1.00000
      7       3.0156     -0.01015
      8       3.3003     -0.00001
      9       4.0233     -0.00000
     10       4.8016     -0.00000
     11       5.6197     -0.00000
     12       7.2697     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8687      1.00000
      3      -0.2750      1.00000
      4      -0.2158      1.00000
      5      -0.0660      1.00000
      6       0.9440      1.00000
      7       1.2710      1.00000
      8       2.4752      0.98468
      9       3.6848     -0.00000
     10       3.8159     -0.00000
     11       5.9764     -0.00000
     12       6.2174     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8687      1.00000
      3      -0.2750      1.00000
      4      -0.2158      1.00000
      5      -0.0660      1.00000
      6       0.9440      1.00000
      7       1.2710      1.00000
      8       2.4752      0.98468
      9       3.6848     -0.00000
     10       3.8159     -0.00000
     11       5.9760     -0.00000
     12       6.2200     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8687      1.00000
      3      -0.2750      1.00000
      4      -0.2158      1.00000
      5      -0.0660      1.00000
      6       0.9440      1.00000
      7       1.2710      1.00000
      8       2.4752      0.98468
      9       3.6848     -0.00000
     10       3.8159     -0.00000
     11       5.9769     -0.00000
     12       6.2158     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7647      1.00000
      3      -0.5078      1.00000
      4      -0.4813      1.00000
      5      -0.3046      1.00000
      6       0.7225      1.00000
      7       1.4334      1.00000
      8       1.7821      1.00000
      9       3.4557     -0.00000
     10       4.5825     -0.00000
     11       4.8567     -0.00000
     12       6.0306     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7647      1.00000
      3      -0.5078      1.00000
      4      -0.4813      1.00000
      5      -0.3046      1.00000
      6       0.7225      1.00000
      7       1.4334      1.00000
      8       1.7821      1.00000
      9       3.4557     -0.00000
     10       4.5825     -0.00000
     11       4.8567     -0.00000
     12       6.0306     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7647      1.00000
      3      -0.5078      1.00000
      4      -0.4813      1.00000
      5      -0.3046      1.00000
      6       0.7225      1.00000
      7       1.4334      1.00000
      8       1.7821      1.00000
      9       3.4557     -0.00000
     10       4.5825     -0.00000
     11       4.8567     -0.00000
     12       6.0306     -0.00000
 Fermi energy:         2.6320158240

 spin component 2

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3672      1.00000
      2     -10.0095      1.00000
      3      -8.0369      1.00000
      4      -5.2257      1.00000
      5      -1.9155      1.00000
      6       2.0384      1.00011
      7       4.5135     -0.00000
      8       6.5232     -0.00000
      9       6.7127     -0.00000
     10      10.8414      0.00000
     11      10.8647      0.00000
     12      15.5302      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2922      1.00000
      2      -9.9343      1.00000
      3      -7.9611      1.00000
      4      -5.1483      1.00000
      5      -1.8395      1.00000
      6       2.1140      1.00077
      7       4.5779     -0.00000
      8       6.5859     -0.00000
      9       6.7741     -0.00000
     10      10.8887      0.00000
     11      10.9203      0.00000
     12      13.9329      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2922      1.00000
      2      -9.9343      1.00000
      3      -7.9611      1.00000
      4      -5.1483      1.00000
      5      -1.8395      1.00000
      6       2.1140      1.00077
      7       4.5779     -0.00000
      8       6.5859     -0.00000
      9       6.7741     -0.00000
     10      10.8887      0.00000
     11      10.9203      0.00000
     12      13.9329      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2922      1.00000
      2      -9.9343      1.00000
      3      -7.9611      1.00000
      4      -5.1483      1.00000
      5      -1.8395      1.00000
      6       2.1140      1.00077
      7       4.5779     -0.00000
      8       6.5859     -0.00000
      9       6.7741     -0.00000
     10      10.8887      0.00000
     11      10.9203      0.00000
     12      13.9329      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0672      1.00000
      2      -9.7085      1.00000
      3      -7.7339      1.00000
      4      -4.9164      1.00000
      5      -1.6116      1.00000
      6       2.3377      1.02894
      7       4.7696     -0.00000
      8       6.7724     -0.00000
      9       6.9557     -0.00000
     10      10.9734      0.00000
     11      11.0804      0.00000
     12      11.9669      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0672      1.00000
      2      -9.7085      1.00000
      3      -7.7339      1.00000
      4      -4.9164      1.00000
      5      -1.6116      1.00000
      6       2.3377      1.02894
      7       4.7696     -0.00000
      8       6.7724     -0.00000
      9       6.9558     -0.00000
     10      10.9734      0.00000
     11      11.0804      0.00000
     12      11.9669      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0672      1.00000
      2      -9.7085      1.00000
      3      -7.7339      1.00000
      4      -4.9164      1.00000
      5      -1.6116      1.00000
      6       2.3377      1.02894
      7       4.7696     -0.00000
      8       6.7724     -0.00000
      9       6.9557     -0.00000
     10      10.9734      0.00000
     11      11.0804      0.00000
     12      11.9669      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3320      1.00000
      3      -7.3551      1.00000
      4      -4.5306      1.00000
      5      -1.2331      1.00000
      6       2.6996      0.23037
      7       5.0842     -0.00000
      8       7.0723     -0.00000
      9       7.2451     -0.00000
     10       9.7565      0.00000
     11      10.6881      0.00000
     12      11.6485      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3320      1.00000
      3      -7.3551      1.00000
      4      -4.5306      1.00000
      5      -1.2331      1.00000
      6       2.6996      0.23037
      7       5.0842     -0.00000
      8       7.0723     -0.00000
      9       7.2451     -0.00000
     10       9.7565      0.00000
     11      10.6881      0.00000
     12      11.5245      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3320      1.00000
      3      -7.3551      1.00000
      4      -4.5306      1.00000
      5      -1.2331      1.00000
      6       2.6996      0.23037
      7       5.0842     -0.00000
      8       7.0723     -0.00000
      9       7.2451     -0.00000
     10       9.7565      0.00000
     11      10.6881      0.00000
     12      12.0807      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1669      1.00000
      2      -8.8047      1.00000
      3      -6.8248      1.00000
      4      -3.9919      1.00000
      5      -0.7063      1.00000
      6       3.1825     -0.00035
      7       5.5021     -0.00000
      8       7.2075     -0.00000
      9       7.5859     -0.00000
     10       8.1068      0.00000
     11       8.7611      0.00000
     12      10.4265      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1669      1.00000
      2      -8.8047      1.00000
      3      -6.8248      1.00000
      4      -3.9919      1.00000
      5      -0.7063      1.00000
      6       3.1825     -0.00035
      7       5.5021     -0.00000
      8       7.2075     -0.00000
      9       7.5859     -0.00000
     10       8.1068      0.00000
     11       8.7611      0.00000
     12      10.4265      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1669      1.00000
      2      -8.8047      1.00000
      3      -6.8248      1.00000
      4      -3.9919      1.00000
      5      -0.7063      1.00000
      6       3.1825     -0.00035
      7       5.5021     -0.00000
      8       7.2075     -0.00000
      9       7.5859     -0.00000
     10       8.1068      0.00000
     11       8.7611      0.00000
     12      10.4265      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1261      1.00000
      3      -6.1426      1.00000
      4      -3.3022      1.00000
      5      -0.0372      1.00000
      6       3.7222     -0.00000
      7       5.3970     -0.00000
      8       6.2514     -0.00000
      9       6.7471     -0.00000
     10       8.1006      0.00000
     11       8.2405      0.00000
     12       8.6120      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1261      1.00000
      3      -6.1426      1.00000
      4      -3.3022      1.00000
      5      -0.0372      1.00000
      6       3.7222     -0.00000
      7       5.3970     -0.00000
      8       6.2514     -0.00000
      9       6.7471     -0.00000
     10       8.1006      0.00000
     11       8.2405      0.00000
     12       8.6120      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4910      1.00000
      2      -8.1261      1.00000
      3      -6.1426      1.00000
      4      -3.3022      1.00000
      5      -0.0372      1.00000
      6       3.7222     -0.00000
      7       5.3970     -0.00000
      8       6.2514     -0.00000
      9       6.7471     -0.00000
     10       8.1006      0.00000
     11       8.2405      0.00000
     12       8.6120      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6641      1.00000
      2      -7.2957      1.00000
      3      -5.3087      1.00000
      4      -2.4663      1.00000
      5       0.7481      1.00000
      6       3.2540     -0.00005
      7       4.5153     -0.00000
      8       5.0348     -0.00000
      9       6.4607     -0.00000
     10       6.9460     -0.00000
     11       8.7622      0.00000
     12       9.3441      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6641      1.00000
      2      -7.2957      1.00000
      3      -5.3087      1.00000
      4      -2.4663      1.00000
      5       0.7481      1.00000
      6       3.2540     -0.00005
      7       4.5153     -0.00000
      8       5.0348     -0.00000
      9       6.4607     -0.00000
     10       6.9460     -0.00000
     11       8.7806      0.00000
     12       9.9808      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6641      1.00000
      2      -7.2957      1.00000
      3      -5.3087      1.00000
      4      -2.4663      1.00000
      5       0.7481      1.00000
      6       3.2540     -0.00005
      7       4.5153     -0.00000
      8       5.0348     -0.00000
      9       6.4607     -0.00000
     10       6.9460     -0.00000
     11       8.7713      0.00000
     12       9.6182      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6853      1.00000
      2      -6.3128      1.00000
      3      -4.3245      1.00000
      4      -1.5040      1.00000
      5       1.1152      1.00000
      6       1.9690      1.00001
      7       2.9143     -0.03107
      8       4.6951     -0.00000
      9       5.5687     -0.00000
     10       7.2789     -0.00000
     11       7.6738     -0.00000
     12      10.2704      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6853      1.00000
      2      -6.3128      1.00000
      3      -4.3245      1.00000
      4      -1.5040      1.00000
      5       1.1152      1.00000
      6       1.9690      1.00001
      7       2.9143     -0.03107
      8       4.6951     -0.00000
      9       5.5687     -0.00000
     10       7.2789     -0.00000
     11       7.6738     -0.00000
     12      10.2783      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6853      1.00000
      2      -6.3128      1.00000
      3      -4.3245      1.00000
      4      -1.5040      1.00000
      5       1.1152      1.00000
      6       1.9690      1.00001
      7       2.9143     -0.03107
      8       4.6951     -0.00000
      9       5.5687     -0.00000
     10       7.2789     -0.00000
     11       7.6738     -0.00000
     12      10.2785      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5536      1.00000
      2      -5.1777      1.00000
      3      -3.1971      1.00000
      4      -0.7651      1.00000
      5      -0.2257      1.00000
      6       1.0720      1.00000
      7       2.8553     -0.03346
      8       3.0974     -0.00240
      9       5.5783     -0.00000
     10       6.5514     -0.00000
     11       8.3007      0.00000
     12       9.5414      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5536      1.00000
      2      -5.1777      1.00000
      3      -3.1971      1.00000
      4      -0.7651      1.00000
      5      -0.2257      1.00000
      6       1.0720      1.00000
      7       2.8553     -0.03346
      8       3.0974     -0.00240
      9       5.5783     -0.00000
     10       6.5514     -0.00000
     11       8.3008      0.00000
     12       9.6790      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5536      1.00000
      2      -5.1777      1.00000
      3      -3.1971      1.00000
      4      -0.7651      1.00000
      5      -0.2257      1.00000
      6       1.0720      1.00000
      7       2.8553     -0.03346
      8       3.0974     -0.00240
      9       5.5783     -0.00000
     10       6.5514     -0.00000
     11       8.3008      0.00000
     12       9.6801      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2689      1.00000
      2      -3.8946      1.00000
      3      -2.2633      1.00000
      4      -1.9823      1.00000
      5      -0.8598      1.00000
      6       0.9068      1.00000
      7       1.5230      1.00000
      8       4.0020     -0.00000
      9       4.1920     -0.00000
     10       6.8818     -0.00000
     11       7.6005     -0.00000
     12       9.8006      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2689      1.00000
      2      -3.8946      1.00000
      3      -2.2633      1.00000
      4      -1.9823      1.00000
      5      -0.8598      1.00000
      6       0.9068      1.00000
      7       1.5230      1.00000
      8       4.0020     -0.00000
      9       4.1920     -0.00000
     10       6.8818     -0.00000
     11       7.6005     -0.00000
     12       9.8006      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2689      1.00000
      2      -3.8946      1.00000
      3      -2.2633      1.00000
      4      -1.9823      1.00000
      5      -0.8598      1.00000
      6       0.9068      1.00000
      7       1.5230      1.00000
      8       4.0020     -0.00000
      9       4.1920     -0.00000
     10       6.8818     -0.00000
     11       7.6005     -0.00000
     12       9.8006      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8569      1.00000
      2      -3.8110      1.00000
      3      -2.5218      1.00000
      4      -2.4516      1.00000
      5      -0.8078      1.00000
      6       0.0337      1.00000
      7       2.3632      1.03363
      8       2.7224      0.15582
      9       5.2682     -0.00000
     10       5.7027     -0.00000
     11       8.4671      0.00000
     12       9.4252      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8569      1.00000
      2      -3.8110      1.00000
      3      -2.5218      1.00000
      4      -2.4516      1.00000
      5      -0.8078      1.00000
      6       0.0337      1.00000
      7       2.3632      1.03363
      8       2.7224      0.15583
      9       5.2682     -0.00000
     10       5.7027     -0.00000
     11       8.4671      0.00000
     12       9.6967      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8569      1.00000
      2      -3.8110      1.00000
      3      -2.5218      1.00000
      4      -2.4516      1.00000
      5      -0.8078      1.00000
      6       0.0337      1.00000
      7       2.3632      1.03363
      8       2.7224      0.15582
      9       5.2682     -0.00000
     10       5.7027     -0.00000
     11       8.4671      0.00000
     12       9.0360      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1422      1.00000
      2      -9.7837      1.00000
      3      -7.8096      1.00000
      4      -4.9936      1.00000
      5      -1.6875      1.00000
      6       2.2637      1.01292
      7       4.7059     -0.00000
      8       6.7106     -0.00000
      9       6.8957     -0.00000
     10      10.9708      0.00000
     11      11.0253      0.00000
     12      12.9341      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1422      1.00000
      2      -9.7837      1.00000
      3      -7.8096      1.00000
      4      -4.9936      1.00000
      5      -1.6875      1.00000
      6       2.2637      1.01292
      7       4.7059     -0.00000
      8       6.7106     -0.00000
      9       6.8957     -0.00000
     10      10.9708      0.00000
     11      11.0253      0.00000
     12      12.9354      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1422      1.00000
      2      -9.7837      1.00000
      3      -7.8096      1.00000
      4      -4.9936      1.00000
      5      -1.6875      1.00000
      6       2.2637      1.01292
      7       4.7059     -0.00000
      8       6.7106     -0.00000
      9       6.8957     -0.00000
     10      10.9708      0.00000
     11      11.0253      0.00000
     12      12.9420      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1718      0.00000
     12      11.4053      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1718      0.00000
     12      11.4053      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1718      0.00000
     12      11.4053      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1718      0.00000
     12      11.4053      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1718      0.00000
     12      11.4053      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8422      1.00000
      2      -9.4826      1.00000
      3      -7.5067      1.00000
      4      -4.6848      1.00000
      5      -1.3843      1.00000
      6       2.5565      0.79482
      7       4.9594     -0.00000
      8       6.9557     -0.00000
      9       7.1329     -0.00000
     10      10.7064      0.00000
     11      11.1718      0.00000
     12      11.4053      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3920      1.00000
      2      -9.0307      1.00000
      3      -7.0521      1.00000
      4      -4.2225      1.00000
      5      -0.9315      1.00000
      6       2.9801     -0.01678
      7       5.3299     -0.00000
      8       7.2859     -0.00000
      9       7.4533     -0.00000
     10       8.8476      0.00000
     11       9.7906      0.00000
     12      11.0448      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7915      1.00000
      2      -8.4278      1.00000
      3      -6.4459      1.00000
      4      -3.6083      1.00000
      5      -0.3327      1.00000
      6       3.5064     -0.00000
      7       5.7380     -0.00000
      8       6.6177     -0.00000
      9       7.7231     -0.00000
     10       7.9030     -0.00000
     11       8.1600      0.00000
     12       9.4912      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0451      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0455      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0438      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0439      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0452      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0401      1.00000
      2      -7.6733      1.00000
      3      -5.6878      1.00000
      4      -2.8448      1.00000
      5       0.4004      1.00000
      6       3.8664     -0.00000
      7       4.7809     -0.00000
      8       5.8338     -0.00000
      9       6.5271     -0.00000
     10       7.5507     -0.00000
     11       8.4372      0.00000
     12       9.0421      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1373      1.00000
      2      -6.7666      1.00000
      3      -4.7784      1.00000
      4      -1.9416      1.00000
      5       1.1830      1.00000
      6       2.4880      0.96681
      7       3.8209     -0.00000
      8       5.2042     -0.00000
      9       5.6599     -0.00000
     10       7.2898     -0.00000
     11       8.1324      0.00000
     12       8.9417      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58055
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58055
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58054
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58055
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58054
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0820      1.00000
      2      -5.7074      1.00000
      3      -3.7211      1.00000
      4      -0.9535      1.00000
      5       0.4458      1.00000
      6       1.8432      1.00000
      7       2.6124      0.58055
      8       3.8690     -0.00000
      9       5.9859     -0.00000
     10       6.5423     -0.00000
     11       8.0912     -0.00000
     12       8.7632      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8735      1.00000
      2      -4.4974      1.00000
      3      -2.5331      1.00000
      4      -1.3904      1.00000
      5      -0.2216      1.00000
      6       0.7471      1.00000
      7       2.1766      1.00299
      8       3.6179     -0.00000
      9       4.8420     -0.00000
     10       7.0345     -0.00000
     11       7.6516     -0.00000
     12       8.5430      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5131      1.00000
      2      -3.1467      1.00000
      3      -3.0061      1.00000
      4      -1.7649      1.00000
      5      -1.0823      1.00000
      6       0.5044      1.00000
      7       1.9122      1.00000
      8       3.3300     -0.00000
      9       4.8339     -0.00000
     10       6.2453     -0.00000
     11       7.9835     -0.00000
     12       8.4854      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1061      1.00000
      3      -7.1279      1.00000
      4      -4.2995      1.00000
      5      -1.0067      1.00000
      6       2.9114     -0.03184
      7       5.2704     -0.00000
      8       7.2502     -0.00000
      9       7.4099     -0.00000
     10       9.9067      0.00000
     11       9.9308      0.00000
     12      10.8649      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1061      1.00000
      3      -7.1279      1.00000
      4      -4.2995      1.00000
      5      -1.0067      1.00000
      6       2.9114     -0.03184
      7       5.2704     -0.00000
      8       7.2502     -0.00000
      9       7.4099     -0.00000
     10       9.9068      0.00000
     11       9.9308      0.00000
     12      10.8456      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1061      1.00000
      3      -7.1279      1.00000
      4      -4.2995      1.00000
      5      -1.0067      1.00000
      6       2.9114     -0.03184
      7       5.2704     -0.00000
      8       7.2502     -0.00000
      9       7.4099     -0.00000
     10       9.9067      0.00000
     11       9.9308      0.00000
     12      10.8477      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9416      1.00000
      2      -8.5786      1.00000
      3      -6.5975      1.00000
      4      -3.7616      1.00000
      5      -0.4813      1.00000
      6       3.3853     -0.00000
      7       5.6822     -0.00000
      8       7.4001     -0.00000
      9       7.6945     -0.00000
     10       8.2736      0.00000
     11       8.9086      0.00000
     12       9.2132      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4217      0.00000
     12       8.5559      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4217      0.00000
     12       8.5559      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4217      0.00000
     12       8.5559      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4217      0.00000
     12       8.5559      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4217      0.00000
     12       8.5559      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2656      1.00000
      2      -7.8998      1.00000
      3      -5.9152      1.00000
      4      -3.0730      1.00000
      5       0.1854      1.00000
      6       3.9166     -0.00000
      7       5.5865     -0.00000
      8       6.4224     -0.00000
      9       6.9282     -0.00000
     10       7.9904     -0.00000
     11       8.4217      0.00000
     12       8.5559      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4383      1.00000
      2      -7.0691      1.00000
      3      -5.0814      1.00000
      4      -2.2392      1.00000
      5       0.9667      1.00000
      6       3.4664     -0.00000
      7       4.7064     -0.00000
      8       5.2010     -0.00000
      9       6.6336     -0.00000
     10       7.0405     -0.00000
     11       7.7392     -0.00000
     12       8.7647      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2462      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2461      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2462      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2462      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2462      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4590      1.00000
      2      -6.0859      1.00000
      3      -4.0977      1.00000
      4      -1.2807      1.00000
      5       1.3334      1.00000
      6       2.1832      1.00339
      7       3.1238     -0.00135
      8       4.8858     -0.00000
      9       5.6675     -0.00000
     10       7.0844     -0.00000
     11       7.4758     -0.00000
     12       8.2462      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3267      1.00000
      2      -4.9508      1.00000
      3      -2.9717      1.00000
      4      -0.5464      1.00000
      5      -0.0027      1.00000
      6       1.2909      1.00000
      7       3.0540     -0.00547
      8       3.3023     -0.00001
      9       5.6606     -0.00000
     10       6.5016     -0.00000
     11       7.1620     -0.00000
     12       8.3035      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0415      1.00000
      2      -3.6682      1.00000
      3      -2.0369      1.00000
      4      -1.7608      1.00000
      5      -0.6377      1.00000
      6       1.1231      1.00000
      7       1.7316      1.00000
      8       4.1563     -0.00000
      9       4.3818     -0.00000
     10       6.5606     -0.00000
     11       7.0742     -0.00000
     12       7.8308     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5823      1.00000
      3      -2.2941      1.00000
      4      -2.2305      1.00000
      5      -0.5915      1.00000
      6       0.2592      1.00000
      7       2.5602      0.78245
      8       2.9086     -0.03229
      9       5.3779     -0.00000
     10       5.8832     -0.00000
     11       6.6861     -0.00000
     12       7.9062     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5823      1.00000
      3      -2.2941      1.00000
      4      -2.2305      1.00000
      5      -0.5915      1.00000
      6       0.2592      1.00000
      7       2.5602      0.78245
      8       2.9086     -0.03229
      9       5.3779     -0.00000
     10       5.8832     -0.00000
     11       6.6861     -0.00000
     12       7.9062     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5823      1.00000
      3      -2.2941      1.00000
      4      -2.2305      1.00000
      5      -0.5915      1.00000
      6       0.2592      1.00000
      7       2.5602      0.78245
      8       2.9086     -0.03229
      9       5.3779     -0.00000
     10       5.8832     -0.00000
     11       6.6861     -0.00000
     12       7.9062     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -7.9753      1.00000
      3      -5.9911      1.00000
      4      -3.1492      1.00000
      5       0.1130      1.00000
      6       3.8865     -0.00000
      7       6.0309     -0.00000
      8       6.9659     -0.00000
      9       7.0148     -0.00000
     10       8.0641     -0.00000
     11       8.1594      0.00000
     12       8.4103      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -7.9753      1.00000
      3      -5.9911      1.00000
      4      -3.1492      1.00000
      5       0.1130      1.00000
      6       3.8865     -0.00000
      7       6.0309     -0.00000
      8       6.9659     -0.00000
      9       7.0148     -0.00000
     10       8.0641     -0.00000
     11       8.1594      0.00000
     12       8.4103      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3407      1.00000
      2      -7.9753      1.00000
      3      -5.9911      1.00000
      4      -3.1492      1.00000
      5       0.1130      1.00000
      6       3.8865     -0.00000
      7       6.0309     -0.00000
      8       6.9659     -0.00000
      9       7.0148     -0.00000
     10       8.0641     -0.00000
     11       8.1594      0.00000
     12       8.4103      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5888      1.00000
      2      -7.2202      1.00000
      3      -5.2330      1.00000
      4      -2.3892      1.00000
      5       0.8382      1.00000
      6       4.2480     -0.00000
      7       5.1052     -0.00000
      8       6.0757     -0.00000
      9       6.3837     -0.00000
     10       7.0119     -0.00000
     11       7.3734     -0.00000
     12       8.0569     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6851      1.00000
      2      -6.3130      1.00000
      3      -4.3243      1.00000
      4      -1.4923      1.00000
      5       1.6083      1.00000
      6       2.9162     -0.03100
      7       4.2279     -0.00000
      8       5.1882     -0.00000
      9       5.9483     -0.00000
     10       6.0688     -0.00000
     11       7.0798     -0.00000
     12       7.6987     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6287      1.00000
      2      -5.2535      1.00000
      3      -3.2690      1.00000
      4      -0.5157      1.00000
      5       0.8883      1.00000
      6       2.2647      1.01334
      7       3.0111     -0.01095
      8       4.2488     -0.00000
      9       5.0950     -0.00000
     10       6.2583     -0.00000
     11       6.6974     -0.00000
     12       7.3751     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70795
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70795
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70795
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70794
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70795
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4191      1.00000
      2      -4.0439      1.00000
      3      -2.0858      1.00000
      4      -0.9422      1.00000
      5       0.2131      1.00000
      6       1.1760      1.00000
      7       2.5806      0.70795
      8       3.9297     -0.00000
      9       4.7626     -0.00000
     10       5.4391     -0.00000
     11       6.4584     -0.00000
     12       7.6783     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0582      1.00000
      2      -2.6963      1.00000
      3      -2.5514      1.00000
      4      -1.3229      1.00000
      5      -0.6402      1.00000
      6       0.9420      1.00000
      7       2.2926      1.01875
      8       3.6038     -0.00000
      9       4.7237     -0.00000
     10       5.4528     -0.00000
     11       6.2332     -0.00000
     12       6.8381     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7604      1.00000
      2      -6.3887      1.00000
      3      -4.3999      1.00000
      4      -1.5643      1.00000
      5       1.5912      1.00000
      6       3.9911     -0.00000
      7       4.2255     -0.00000
      8       5.2833     -0.00000
      9       5.5021     -0.00000
     10       6.0253     -0.00000
     11       7.0946     -0.00000
     12       7.4085     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7604      1.00000
      2      -6.3887      1.00000
      3      -4.3999      1.00000
      4      -1.5643      1.00000
      5       1.5912      1.00000
      6       3.9911     -0.00000
      7       4.2255     -0.00000
      8       5.2833     -0.00000
      9       5.5021     -0.00000
     10       6.0253     -0.00000
     11       7.0946     -0.00000
     12       7.4085     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7604      1.00000
      2      -6.3887      1.00000
      3      -4.3999      1.00000
      4      -1.5643      1.00000
      5       1.5912      1.00000
      6       3.9911     -0.00000
      7       4.2255     -0.00000
      8       5.2833     -0.00000
      9       5.5021     -0.00000
     10       6.0253     -0.00000
     11       7.0946     -0.00000
     12       7.4085     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7796      1.00000
      2      -5.4049      1.00000
      3      -3.4186      1.00000
      4      -0.6222      1.00000
      5       1.9567      1.00001
      6       2.7435      0.09929
      7       3.7093     -0.00000
      8       3.7931     -0.00000
      9       4.9023     -0.00000
     10       5.5631     -0.00000
     11       6.5654     -0.00000
     12       7.0137     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6457      1.00000
      2      -4.2701      1.00000
      3      -2.2984      1.00000
      4       0.1054      1.00000
      5       0.6432      1.00000
      6       1.9097      1.00000
      7       3.1309     -0.00119
      8       3.6563     -0.00000
      9       4.0430     -0.00000
     10       4.8232     -0.00000
     11       6.3804     -0.00000
     12       6.9121     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3594      1.00000
      2      -2.9901      1.00000
      3      -1.3606      1.00000
      4      -1.1002      1.00000
      5       0.0234      1.00000
      6       1.7251      1.00000
      7       2.2448      1.00983
      8       3.0557     -0.00535
      9       4.3301     -0.00000
     10       5.0810     -0.00000
     11       5.3366     -0.00000
     12       6.5261     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9529      1.00000
      2      -2.8978      1.00000
      3      -1.6143      1.00000
      4      -1.5683      1.00000
      5       0.0507      1.00000
      6       0.9163      1.00000
      7       2.7055      0.21266
      8       2.9548     -0.02224
      9       3.8814     -0.00000
     10       4.7823     -0.00000
     11       6.1620     -0.00000
     12       6.4725     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9529      1.00000
      2      -2.8978      1.00000
      3      -1.6143      1.00000
      4      -1.5683      1.00000
      5       0.0507      1.00000
      6       0.9163      1.00000
      7       2.7055      0.21266
      8       2.9548     -0.02224
      9       3.8814     -0.00000
     10       4.7823     -0.00000
     11       6.1620     -0.00000
     12       6.4725     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9529      1.00000
      2      -2.8978      1.00000
      3      -1.6143      1.00000
      4      -1.5683      1.00000
      5       0.0507      1.00000
      6       0.9163      1.00000
      7       2.7055      0.21266
      8       2.9548     -0.02224
      9       3.8814     -0.00000
     10       4.7823     -0.00000
     11       6.1621     -0.00000
     12       6.4725     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3456      1.00000
      3      -2.3706      1.00000
      4       0.3013      1.00000
      5       1.6014      1.00000
      6       1.9010      1.00000
      7       3.0156     -0.01015
      8       3.3003     -0.00001
      9       4.0233     -0.00000
     10       4.8016     -0.00000
     11       5.6197     -0.00000
     12       7.2697     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3456      1.00000
      3      -2.3706      1.00000
      4       0.3013      1.00000
      5       1.6014      1.00000
      6       1.9010      1.00000
      7       3.0156     -0.01015
      8       3.3003     -0.00001
      9       4.0233     -0.00000
     10       4.8016     -0.00000
     11       5.6197     -0.00000
     12       7.2697     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7212      1.00000
      2      -4.3456      1.00000
      3      -2.3706      1.00000
      4       0.3013      1.00000
      5       1.6014      1.00000
      6       1.9010      1.00000
      7       3.0156     -0.01015
      8       3.3003     -0.00001
      9       4.0233     -0.00000
     10       4.8016     -0.00000
     11       5.6197     -0.00000
     12       7.2697     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5102      1.00000
      2      -3.1388      1.00000
      3      -1.2031      1.00000
      4      -0.0520      1.00000
      5       1.0124      1.00000
      6       1.3673      1.00000
      7       2.0537      1.00017
      8       2.8003     -0.00159
      9       3.6832     -0.00000
     10       4.9236     -0.00000
     11       5.0842     -0.00000
     12       6.3168     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1501      1.00000
      2      -1.8010      1.00000
      3      -1.6458      1.00000
      4      -0.4474      1.00000
      5       0.2175      1.00000
      6       1.2560      1.00000
      7       1.7503      1.00000
      8       2.3645      1.03396
      9       3.6870     -0.00000
     10       4.6195     -0.00000
     11       5.1512     -0.00000
     12       6.1525     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8687      1.00000
      3      -0.2750      1.00000
      4      -0.2158      1.00000
      5      -0.0660      1.00000
      6       0.9440      1.00000
      7       1.2710      1.00000
      8       2.4752      0.98468
      9       3.6848     -0.00000
     10       3.8159     -0.00000
     11       5.9762     -0.00000
     12       6.2199     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8687      1.00000
      3      -0.2750      1.00000
      4      -0.2158      1.00000
      5      -0.0660      1.00000
      6       0.9440      1.00000
      7       1.2710      1.00000
      8       2.4752      0.98468
      9       3.6848     -0.00000
     10       3.8159     -0.00000
     11       5.9763     -0.00000
     12       6.2208     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2248      1.00000
      2      -1.8687      1.00000
      3      -0.2750      1.00000
      4      -0.2158      1.00000
      5      -0.0660      1.00000
      6       0.9440      1.00000
      7       1.2710      1.00000
      8       2.4752      0.98468
      9       3.6848     -0.00000
     10       3.8159     -0.00000
     11       5.9757     -0.00000
     12       6.2191     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7647      1.00000
      3      -0.5078      1.00000
      4      -0.4813      1.00000
      5      -0.3046      1.00000
      6       0.7225      1.00000
      7       1.4334      1.00000
      8       1.7821      1.00000
      9       3.4557     -0.00000
     10       4.5825     -0.00000
     11       4.8567     -0.00000
     12       6.0306     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7647      1.00000
      3      -0.5078      1.00000
      4      -0.4813      1.00000
      5      -0.3046      1.00000
      6       0.7225      1.00000
      7       1.4334      1.00000
      8       1.7821      1.00000
      9       3.4557     -0.00000
     10       4.5825     -0.00000
     11       4.8567     -0.00000
     12       6.0306     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7647      1.00000
      3      -0.5078      1.00000
      4      -0.4813      1.00000
      5      -0.3046      1.00000
      6       0.7225      1.00000
      7       1.4334      1.00000
      8       1.7821      1.00000
      9       3.4557     -0.00000
     10       4.5825     -0.00000
     11       4.8567     -0.00000
     12       6.0306     -0.00000


--------------------------------------------------------------------------------------------------------


 soft charge-density along one line, spin component           1
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 soft charge-density along one line, spin component           2
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 pseudopotential strength for first ion, spin component:           1
  8.085  13.802   0.000  -0.002  -0.000   0.000  -0.006  -0.000
 13.802  23.555   0.000  -0.003  -0.000   0.000  -0.010  -0.000
  0.000   0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880  -0.000  -0.000   5.472  -0.000
 -0.000  -0.000   0.000  -0.000   1.879   0.000  -0.000   5.469
  0.000   0.000   5.469  -0.000   0.000  15.775  -0.000   0.000
 -0.006  -0.010  -0.000   5.472  -0.000  -0.000  15.783  -0.000
 -0.000  -0.000   0.000  -0.000   5.469   0.000  -0.000  15.775
 pseudopotential strength for first ion, spin component:           2
  8.085  13.802  -0.000  -0.002  -0.000  -0.000  -0.006  -0.000
 13.802  23.555  -0.000  -0.003  -0.000  -0.000  -0.010  -0.000
 -0.000  -0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880  -0.000  -0.000   5.472  -0.000
 -0.000  -0.000   0.000  -0.000   1.879   0.000  -0.000   5.469
 -0.000  -0.000   5.469  -0.000   0.000  15.775  -0.000   0.000
 -0.006  -0.010  -0.000   5.472  -0.000  -0.000  15.783  -0.000
 -0.000  -0.000   0.000  -0.000   5.469   0.000  -0.000  15.775
 total augmentation occupancy for first ion, spin component:           1
116.849 -62.405  -0.000  -0.171  -0.000   0.000  -0.009   0.000
-62.405  33.329   0.000   0.082   0.000  -0.000   0.006  -0.000
 -0.000   0.000   2.104   0.000  -0.000  -0.326  -0.000   0.000
 -0.171   0.082   0.000   1.665   0.000  -0.000  -0.256  -0.000
 -0.000   0.000  -0.000   0.000   2.104   0.000  -0.000  -0.326
  0.000  -0.000  -0.326  -0.000   0.000   0.051   0.000  -0.000
 -0.009   0.006  -0.000  -0.256  -0.000   0.000   0.039   0.000
  0.000  -0.000   0.000  -0.000  -0.326  -0.000   0.000   0.051
 total augmentation occupancy for first ion, spin component:           2
 -0.000   0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000
  0.000  -0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000
  0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000
  0.000  -0.000  -0.000   0.000   0.000   0.000  -0.000  -0.000
  0.000  -0.000   0.000   0.000  -0.000   0.000  -0.000   0.000
 -0.000   0.000  -0.000   0.000   0.000  -0.000  -0.000  -0.000
 -0.000   0.000   0.000  -0.000  -0.000  -0.000  -0.000   0.000
 -0.000   0.000  -0.000  -0.000   0.000  -0.000   0.000  -0.000


------------------------ aborting loop because EDIFF is reached ----------------------------------------


    FORLOC:  cpu time      0.0008: real time      0.0008
    FORHF :  cpu time   1056.6338: real time   1060.8243
    FORNL :  cpu time      0.2682: real time      0.2697
    FORCOR:  cpu time      1.1776: real time      1.1810
    OFIELD:  cpu time      0.0001: real time      0.0001

 VOLUME and BASIS-vectors are now :
 -----------------------------------------------------------------------------
  energy-cutoff  :      400.00
  volume of cell :      120.20
      direct lattice vectors                 reciprocal lattice vectors
     2.857459769  0.000000000  0.000000000     0.349961183 -0.202050183  0.000000000
     1.428729885  2.474632750  0.000000000     0.000000000  0.404100366  0.000000000
     0.000000000  0.000000000 16.999318395     0.000000000  0.000000000  0.058825888

  length of vectors
     2.857459769  2.857459769 16.999318395     0.404100366  0.404100366  0.058825888


 FORCES acting on ions:
    Electron-Ion                     Ewald-Force                    Non-Local-Force
 -----------------------------------------------------------------------------------------------
   0.120E-06 0.151E-06 0.156E+03   0.406E-13 0.245E-13 -.155E+03   -.138E-06 -.212E-06 -.113E+01
   -.937E-06 -.134E-05 0.520E+02   -.140E-12 -.844E-13 -.520E+02   0.107E-05 0.137E-05 0.942E-01
   0.192E-05 -.922E-06 -.533E+02   0.140E-12 0.898E-13 0.532E+02   -.179E-05 0.785E-06 0.145E+00
   -.886E-06 0.178E-05 -.155E+03   -.401E-13 -.251E-13 0.154E+03   0.709E-06 -.202E-05 0.891E+00
 -----------------------------------------------------------------------------------------------
   -.592E-06 -.820E-06 -.101E-01   0.721E-15 0.484E-14 0.284E-13   -.148E-06 -.766E-07 0.375E-02
 
 
 POSITION                                       TOTAL-FORCE (eV/Angst)
 -----------------------------------------------------------------------------------
      0.00000      0.00000      0.00000         0.000000      0.000000     -0.101976
      1.42873      0.82488      2.33311        -0.000001     -0.000000      0.098911
      2.85746      1.64976      4.63760         0.000001      0.000000      0.010447
      0.00000      0.00000      7.01593         0.000000      0.000000     -0.007382
 -----------------------------------------------------------------------------------
    total drift:                               -0.000001     -0.000001     -0.005499


--------------------------------------------------------------------------------------------------------



  FREE ENERGIE OF THE ION-ELECTRON SYSTEM (eV)
  ---------------------------------------------------
  free  energy   TOTEN  =       -10.94945264 eV

  energy  without entropy=      -10.94981479  energy(sigma->0) =      -10.94957336
 
 d Force =-0.8603967E-05[-0.322E-04, 0.150E-04]  d Energy =-0.1211699E-04 0.351E-05
 d Force = 0.8219642E-01[ 0.820E-01, 0.823E-01]  d Ewald  = 0.8219643E-01-0.122E-07


--------------------------------------------------------------------------------------------------------


    POTLOK:  cpu time      1.1782: real time      1.1816


--------------------------------------------------------------------------------------------------------


 Quasi-Newton relaxation of ions (Broydens 2nd method)
  g(Force)  = 0.789E-05   g(Stress)= 0.000E+00

 retain information from N=  1 steps
 eigenvalues of (default step * inverse Hessian matrix)
  average eigenvalue of G=   2.7919
 eigenvalue spectrum of G is  2.7919


--------------------------------------------------------------------------------------------------------


    WAVPRE:  cpu time      0.0038: real time      0.0967
    FEWALD:  cpu time      0.0002: real time      0.0002
    ORTHCH:  cpu time      0.0925: real time      0.0928
    POTLOK:  cpu time      1.1780: real time      1.1814
    EDDIAG:  cpu time   1292.5367: real time   1297.7346
    CHARGE:  cpu time      0.2435: real time      0.2445
 writing wavefunctions
     LOOP+:  cpu time  11400.1996: real time  11446.8143


--------------------------------------- Iteration      6(   1)  ---------------------------------------


    POTLOK:  cpu time      0.3898: real time      0.3912
    SETDIJ:  cpu time      0.7915: real time      0.7935
    TRIAL :  cpu time   1289.7786: real time   1295.0362
    CORREC:  cpu time      0.0068: real time      0.0068
    CHARGE:  cpu time      0.2418: real time      0.2428
    --------------------------------------------
      LOOP:  cpu time   1291.2179: real time   1296.4800

 eigenvalue-minimisations  :     0
 total energy-change (2. order) : 0.2103566E-03  (-0.5640275E-03)
 number of electron      12.0000000 magnetization      -0.0000000
 augmentation part       -0.0018906 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.59811086
  -Hartree energ DENC   =      -507.91264742
  -exchange      EXHF   =        26.47730532
  -V(xc)+E(xc)   XCENC  =       -66.89611507
  PAW double counting   =     82061.31437623   -81980.55075805
  entropy T*S    EENTRO =         0.00032857
  eigenvalues    EBANDS =       -34.88927127
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94923240 eV

  energy without entropy =      -10.94956097  energy(sigma->0) =      -10.94934192
  exchange ACFDT corr.  =        -0.00054645  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      6(   2)  ---------------------------------------


    POTLOK:  cpu time      0.3866: real time      0.3879
    SETDIJ:  cpu time      0.7900: real time      0.7920
    TRIAL :  cpu time   1287.9033: real time   1293.1927
    CORREC:  cpu time      0.0064: real time      0.0065
    CHARGE:  cpu time      0.2429: real time      0.2439
    --------------------------------------------
      LOOP:  cpu time   1289.3296: real time   1294.6234

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.1529228E-03  (-0.4718386E-04)
 number of electron      12.0000000 magnetization      -0.0000000
 augmentation part       -0.0018898 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.59811086
  -Hartree energ DENC   =      -507.97106534
  -exchange      EXHF   =        26.47776028
  -V(xc)+E(xc)   XCENC  =       -66.89594428
  PAW double counting   =     82063.20254188   -81982.43896843
  entropy T*S    EENTRO =         0.00032425
  eigenvalues    EBANDS =       -34.83158202
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94938532 eV

  energy without entropy =      -10.94970957  energy(sigma->0) =      -10.94949340
  exchange ACFDT corr.  =        -0.00055020  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      6(   3)  ---------------------------------------


    POTLOK:  cpu time      0.3875: real time      0.3888
    SETDIJ:  cpu time      0.7918: real time      0.7938
    TRIAL :  cpu time   1289.4574: real time   1294.5958
    CORREC:  cpu time      0.0065: real time      0.0065
    CHARGE:  cpu time      0.2427: real time      0.2438
    --------------------------------------------
      LOOP:  cpu time   1290.8865: real time   1296.0292

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.3573141E-04  (-0.1463281E-03)
 number of electron      12.0000000 magnetization      -0.0000001
 augmentation part       -0.0018884 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.59811086
  -Hartree energ DENC   =      -508.01159361
  -exchange      EXHF   =        26.47807760
  -V(xc)+E(xc)   XCENC  =       -66.89581581
  PAW double counting   =     82065.94926170   -81985.18569542
  entropy T*S    EENTRO =         0.00032290
  eigenvalues    EBANDS =       -34.79152378
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94942105 eV

  energy without entropy =      -10.94974395  energy(sigma->0) =      -10.94952869
  exchange ACFDT corr.  =        -0.00055071  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      6(   4)  ---------------------------------------


    POTLOK:  cpu time      0.3864: real time      0.3878
    SETDIJ:  cpu time      0.7915: real time      0.7935
    TRIAL :  cpu time   1293.8041: real time   1299.0423
    CORREC:  cpu time      0.0061: real time      0.0061
    CHARGE:  cpu time      0.2426: real time      0.2436
    --------------------------------------------
      LOOP:  cpu time   1295.2311: real time   1300.4736

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.3307480E-04  (-0.1157671E-04)
 number of electron      12.0000000 magnetization      -0.0000001
 augmentation part       -0.0018859 magnetization      -0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.59811086
  -Hartree energ DENC   =      -508.01690075
  -exchange      EXHF   =        26.47813591
  -V(xc)+E(xc)   XCENC  =       -66.89577980
  PAW double counting   =     82069.07504388   -81988.31145961
  entropy T*S    EENTRO =         0.00032373
  eigenvalues    EBANDS =       -34.78636067
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94945413 eV

  energy without entropy =      -10.94977785  energy(sigma->0) =      -10.94956204
  exchange ACFDT corr.  =        -0.00055144  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      6(   5)  ---------------------------------------


    POTLOK:  cpu time      0.3870: real time      0.3884
    SETDIJ:  cpu time      0.7910: real time      0.7931
    TRIAL :  cpu time   1291.3394: real time   1296.5985
    CORREC:  cpu time      0.0067: real time      0.0067
    CHARGE:  cpu time      0.2441: real time      0.2451
    --------------------------------------------
      LOOP:  cpu time   1292.7689: real time   1298.0324

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.9024472E-05  (-0.3681624E-04)
 number of electron      12.0000000 magnetization      -0.0000001
 augmentation part       -0.0018830 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.59811086
  -Hartree energ DENC   =      -508.00657840
  -exchange      EXHF   =        26.47806629
  -V(xc)+E(xc)   XCENC  =       -66.89579612
  PAW double counting   =     82072.44836534   -81991.68476657
  entropy T*S    EENTRO =         0.00032554
  eigenvalues    EBANDS =       -34.79662144
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94946315 eV

  energy without entropy =      -10.94978869  energy(sigma->0) =      -10.94957166
  exchange ACFDT corr.  =        -0.00055085  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------




--------------------------------------- Iteration      6(   6)  ---------------------------------------


    POTLOK:  cpu time      0.3881: real time      0.3895
    SETDIJ:  cpu time      0.7902: real time      0.7922
    TRIAL :  cpu time   1287.7900: real time   1293.0686
    CORREC:  cpu time      0.0070: real time      0.0070
    EDDIAG:  cpu time   1292.6807: real time   1297.8964
    CHARGE:  cpu time      0.2423: real time      0.2433
    --------------------------------------------
      LOOP:  cpu time   2581.8987: real time   2592.3975

 eigenvalue-minimisations  :     0
 total energy-change (2. order) :-0.6751419E-05  (-0.5087548E-05)
 number of electron      12.0000000 magnetization      -0.0000001
 augmentation part       -0.0018805 magnetization       0.0000000

 Free energy of the ion-electron system (eV)
  ---------------------------------------------------
  alpha Z        PSCENC =        -0.44707771
  Ewald energy   TEWEN  =       276.59811086
  -Hartree energ DENC   =      -507.99761628
  -exchange      EXHF   =        26.47788854
  -V(xc)+E(xc)   XCENC  =       -66.89582779
  PAW double counting   =     82075.86701861   -81995.10340854
  entropy T*S    EENTRO =         0.00032752
  eigenvalues    EBANDS =       -34.80547467
  atomic energy  EATOM  =       215.35651086
  ---------------------------------------------------
  free energy    TOTEN  =       -10.94946990 eV

  energy without entropy =      -10.94979742  energy(sigma->0) =      -10.94957908
  exchange ACFDT corr.  =        -0.00054997  see jH, gK, PRB 81, 115126


--------------------------------------------------------------------------------------------------------


  average scaling for gradient   1.0900


 average (electrostatic) potential at core
  the test charge radii are     1.0406
  (the norm of the test charge is              1.0000)
       1 -70.4127       2 -70.3825       3 -70.4036       4 -70.4596
 
 
 
 E-fermi :   2.6320     XC(G=0):  -4.7787     alpha+bet : -8.1680

 Fermi energy:         2.6319706378

 spin component 1

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3671      1.00000
      2     -10.0112      1.00000
      3      -8.0354      1.00000
      4      -5.2250      1.00000
      5      -1.9151      1.00000
      6       2.0386      1.00011
      7       4.5144     -0.00000
      8       6.5229     -0.00000
      9       6.7139     -0.00000
     10      10.8419      0.00000
     11      10.8647      0.00000
     12      15.5345      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2921      1.00000
      2      -9.9359      1.00000
      3      -7.9596      1.00000
      4      -5.1476      1.00000
      5      -1.8390      1.00000
      6       2.1143      1.00077
      7       4.5787     -0.00000
      8       6.5856     -0.00000
      9       6.7753     -0.00000
     10      10.8893      0.00000
     11      10.9204      0.00000
     12      13.9329      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2921      1.00000
      2      -9.9359      1.00000
      3      -7.9596      1.00000
      4      -5.1476      1.00000
      5      -1.8390      1.00000
      6       2.1143      1.00077
      7       4.5787     -0.00000
      8       6.5856     -0.00000
      9       6.7753     -0.00000
     10      10.8893      0.00000
     11      10.9204      0.00000
     12      13.9329      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2921      1.00000
      2      -9.9359      1.00000
      3      -7.9596      1.00000
      4      -5.1476      1.00000
      5      -1.8390      1.00000
      6       2.1143      1.00077
      7       4.5787     -0.00000
      8       6.5856     -0.00000
      9       6.7753     -0.00000
     10      10.8893      0.00000
     11      10.9204      0.00000
     12      13.9329      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0671      1.00000
      2      -9.7101      1.00000
      3      -7.7324      1.00000
      4      -4.9157      1.00000
      5      -1.6111      1.00000
      6       2.3379      1.02896
      7       4.7704     -0.00000
      8       6.7720     -0.00000
      9       6.9569     -0.00000
     10      10.9740      0.00000
     11      11.0805      0.00000
     12      11.9667      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0671      1.00000
      2      -9.7101      1.00000
      3      -7.7324      1.00000
      4      -4.9157      1.00000
      5      -1.6111      1.00000
      6       2.3379      1.02896
      7       4.7704     -0.00000
      8       6.7720     -0.00000
      9       6.9569     -0.00000
     10      10.9740      0.00000
     11      11.0805      0.00000
     12      11.9667      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0671      1.00000
      2      -9.7101      1.00000
      3      -7.7324      1.00000
      4      -4.9157      1.00000
      5      -1.6111      1.00000
      6       2.3379      1.02896
      7       4.7704     -0.00000
      8       6.7720     -0.00000
      9       6.9569     -0.00000
     10      10.9740      0.00000
     11      11.0805      0.00000
     12      11.9667      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3337      1.00000
      3      -7.3537      1.00000
      4      -4.5299      1.00000
      5      -1.2326      1.00000
      6       2.6999      0.22992
      7       5.0850     -0.00000
      8       7.0720     -0.00000
      9       7.2462     -0.00000
     10       9.7570      0.00000
     11      10.6865      0.00000
     12      12.0587      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3337      1.00000
      3      -7.3537      1.00000
      4      -4.5299      1.00000
      5      -1.2326      1.00000
      6       2.6999      0.22992
      7       5.0850     -0.00000
      8       7.0720     -0.00000
      9       7.2462     -0.00000
     10       9.7570      0.00000
     11      10.6865      0.00000
     12      11.6412      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3337      1.00000
      3      -7.3537      1.00000
      4      -4.5299      1.00000
      5      -1.2326      1.00000
      6       2.6999      0.22993
      7       5.0850     -0.00000
      8       7.0720     -0.00000
      9       7.2462     -0.00000
     10       9.7570      0.00000
     11      10.6865      0.00000
     12      11.5163      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1668      1.00000
      2      -8.8064      1.00000
      3      -6.8233      1.00000
      4      -3.9912      1.00000
      5      -0.7058      1.00000
      6       3.1828     -0.00035
      7       5.5028     -0.00000
      8       7.2078     -0.00000
      9       7.5860     -0.00000
     10       8.1076      0.00000
     11       8.7594      0.00000
     12      10.4279      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1668      1.00000
      2      -8.8064      1.00000
      3      -6.8233      1.00000
      4      -3.9912      1.00000
      5      -0.7058      1.00000
      6       3.1828     -0.00035
      7       5.5028     -0.00000
      8       7.2078     -0.00000
      9       7.5860     -0.00000
     10       8.1076      0.00000
     11       8.7594      0.00000
     12      10.4279      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1668      1.00000
      2      -8.8064      1.00000
      3      -6.8233      1.00000
      4      -3.9912      1.00000
      5      -0.7058      1.00000
      6       3.1828     -0.00035
      7       5.5028     -0.00000
      8       7.2078     -0.00000
      9       7.5860     -0.00000
     10       8.1076      0.00000
     11       8.7594      0.00000
     12      10.4279      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4909      1.00000
      2      -8.1278      1.00000
      3      -6.1411      1.00000
      4      -3.3015      1.00000
      5      -0.0368      1.00000
      6       3.7225     -0.00000
      7       5.3971     -0.00000
      8       6.2522     -0.00000
      9       6.7454     -0.00000
     10       8.1007      0.00000
     11       8.2411      0.00000
     12       8.6135      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4909      1.00000
      2      -8.1278      1.00000
      3      -6.1411      1.00000
      4      -3.3015      1.00000
      5      -0.0368      1.00000
      6       3.7225     -0.00000
      7       5.3971     -0.00000
      8       6.2522     -0.00000
      9       6.7454     -0.00000
     10       8.1007      0.00000
     11       8.2411      0.00000
     12       8.6135      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4909      1.00000
      2      -8.1278      1.00000
      3      -6.1411      1.00000
      4      -3.3015      1.00000
      5      -0.0368      1.00000
      6       3.7225     -0.00000
      7       5.3971     -0.00000
      8       6.2522     -0.00000
      9       6.7454     -0.00000
     10       8.1007      0.00000
     11       8.2411      0.00000
     12       8.6135      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6640      1.00000
      2      -7.2974      1.00000
      3      -5.3072      1.00000
      4      -2.4656      1.00000
      5       0.7485      1.00000
      6       3.2545     -0.00005
      7       4.5142     -0.00000
      8       5.0342     -0.00000
      9       6.4620     -0.00000
     10       6.9468     -0.00000
     11       8.7767      0.00000
     12      10.3326      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6640      1.00000
      2      -7.2974      1.00000
      3      -5.3072      1.00000
      4      -2.4656      1.00000
      5       0.7485      1.00000
      6       3.2545     -0.00005
      7       4.5142     -0.00000
      8       5.0342     -0.00000
      9       6.4620     -0.00000
     10       6.9468     -0.00000
     11       8.7759      0.00000
     12      10.2054      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6640      1.00000
      2      -7.2974      1.00000
      3      -5.3072      1.00000
      4      -2.4656      1.00000
      5       0.7485      1.00000
      6       3.2545     -0.00005
      7       4.5142     -0.00000
      8       5.0342     -0.00000
      9       6.4620     -0.00000
     10       6.9468     -0.00000
     11       8.7775      0.00000
     12      10.6284      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3146      1.00000
      3      -4.3230      1.00000
      4      -1.5034      1.00000
      5       1.1153      1.00000
      6       1.9697      1.00001
      7       2.9125     -0.03183
      8       4.6967     -0.00000
      9       5.5687     -0.00000
     10       7.2794     -0.00000
     11       7.6746     -0.00000
     12      10.2745      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3146      1.00000
      3      -4.3230      1.00000
      4      -1.5034      1.00000
      5       1.1153      1.00000
      6       1.9697      1.00001
      7       2.9125     -0.03183
      8       4.6967     -0.00000
      9       5.5687     -0.00000
     10       7.2794     -0.00000
     11       7.6746     -0.00000
     12      10.2776      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3146      1.00000
      3      -4.3230      1.00000
      4      -1.5034      1.00000
      5       1.1153      1.00000
      6       1.9697      1.00001
      7       2.9125     -0.03183
      8       4.6967     -0.00000
      9       5.5687     -0.00000
     10       7.2794     -0.00000
     11       7.6746     -0.00000
     12      10.2785      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5534      1.00000
      2      -5.1795      1.00000
      3      -3.1956      1.00000
      4      -0.7647      1.00000
      5      -0.2257      1.00000
      6       1.0709      1.00000
      7       2.8559     -0.03347
      8       3.0986     -0.00236
      9       5.5788     -0.00000
     10       6.5516     -0.00000
     11       8.3013      0.00000
     12       9.7405      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5534      1.00000
      2      -5.1795      1.00000
      3      -3.1956      1.00000
      4      -0.7647      1.00000
      5      -0.2257      1.00000
      6       1.0709      1.00000
      7       2.8559     -0.03347
      8       3.0986     -0.00236
      9       5.5788     -0.00000
     10       6.5516     -0.00000
     11       8.3013      0.00000
     12       9.7325      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5534      1.00000
      2      -5.1795      1.00000
      3      -3.1956      1.00000
      4      -0.7647      1.00000
      5      -0.2257      1.00000
      6       1.0709      1.00000
      7       2.8559     -0.03347
      8       3.0986     -0.00236
      9       5.5788     -0.00000
     10       6.5516     -0.00000
     11       8.3013      0.00000
     12       9.6098      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2688      1.00000
      2      -3.8965      1.00000
      3      -2.2630      1.00000
      4      -1.9812      1.00000
      5      -0.8614      1.00000
      6       0.9083      1.00000
      7       1.5238      1.00000
      8       4.0032     -0.00000
      9       4.1919     -0.00000
     10       6.8822     -0.00000
     11       7.6010     -0.00000
     12       9.8007      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2688      1.00000
      2      -3.8965      1.00000
      3      -2.2630      1.00000
      4      -1.9812      1.00000
      5      -0.8614      1.00000
      6       0.9083      1.00000
      7       1.5238      1.00000
      8       4.0032     -0.00000
      9       4.1919     -0.00000
     10       6.8822     -0.00000
     11       7.6010     -0.00000
     12       9.8007      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2688      1.00000
      2      -3.8965      1.00000
      3      -2.2630      1.00000
      4      -1.9812      1.00000
      5      -0.8614      1.00000
      6       0.9083      1.00000
      7       1.5238      1.00000
      8       4.0032     -0.00000
      9       4.1919     -0.00000
     10       6.8822     -0.00000
     11       7.6010     -0.00000
     12       9.8007      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8570      1.00000
      2      -3.8106      1.00000
      3      -2.5236      1.00000
      4      -2.4535      1.00000
      5      -0.8065      1.00000
      6       0.0356      1.00000
      7       2.3637      1.03363
      8       2.7232      0.15654
      9       5.2683     -0.00000
     10       5.7035     -0.00000
     11       8.4678      0.00000
     12       9.1086      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8570      1.00000
      2      -3.8106      1.00000
      3      -2.5236      1.00000
      4      -2.4535      1.00000
      5      -0.8065      1.00000
      6       0.0356      1.00000
      7       2.3637      1.03363
      8       2.7232      0.15654
      9       5.2683     -0.00000
     10       5.7035     -0.00000
     11       8.4678      0.00000
     12       9.6373      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8570      1.00000
      2      -3.8106      1.00000
      3      -2.5236      1.00000
      4      -2.4535      1.00000
      5      -0.8065      1.00000
      6       0.0356      1.00000
      7       2.3637      1.03363
      8       2.7232      0.15654
      9       5.2684     -0.00000
     10       5.7035     -0.00000
     11       8.4678      0.00000
     12       9.6361      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1421      1.00000
      2      -9.7854      1.00000
      3      -7.8082      1.00000
      4      -4.9930      1.00000
      5      -1.6870      1.00000
      6       2.2639      1.01294
      7       4.7067     -0.00000
      8       6.7102     -0.00000
      9       6.8969     -0.00000
     10      10.9715      0.00000
     11      11.0254      0.00000
     12      12.9518      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1421      1.00000
      2      -9.7854      1.00000
      3      -7.8082      1.00000
      4      -4.9930      1.00000
      5      -1.6870      1.00000
      6       2.2639      1.01294
      7       4.7067     -0.00000
      8       6.7102     -0.00000
      9       6.8969     -0.00000
     10      10.9715      0.00000
     11      11.0254      0.00000
     12      12.9371      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1421      1.00000
      2      -9.7854      1.00000
      3      -7.8082      1.00000
      4      -4.9930      1.00000
      5      -1.6870      1.00000
      6       2.2639      1.01294
      7       4.7067     -0.00000
      8       6.7102     -0.00000
      9       6.8969     -0.00000
     10      10.9715      0.00000
     11      11.0254      0.00000
     12      12.9383      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79439
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1729      0.00000
     12      11.4161      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79439
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1729      0.00000
     12      11.4161      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79439
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1729      0.00000
     12      11.4161      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79439
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1729      0.00000
     12      11.4161      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79439
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1729      0.00000
     12      11.4161      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79439
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1729      0.00000
     12      11.4161      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       9.0104      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       9.0103      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       9.0104      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       9.0103      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       9.0105      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       9.0105      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7634      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7634      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7634      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7634      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7634      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7634      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1078      1.00000
      3      -7.1264      1.00000
      4      -4.2988      1.00000
      5      -1.0062      1.00000
      6       2.9116     -0.03182
      7       5.2712     -0.00000
      8       7.2500     -0.00000
      9       7.4109     -0.00000
     10       9.9081      0.00000
     11       9.9301      0.00000
     12      10.8620      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1078      1.00000
      3      -7.1264      1.00000
      4      -4.2988      1.00000
      5      -1.0062      1.00000
      6       2.9116     -0.03182
      7       5.2712     -0.00000
      8       7.2500     -0.00000
      9       7.4109     -0.00000
     10       9.9080      0.00000
     11       9.9301      0.00000
     12      10.8739      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1078      1.00000
      3      -7.1264      1.00000
      4      -4.2988      1.00000
      5      -1.0062      1.00000
      6       2.9116     -0.03182
      7       5.2712     -0.00000
      8       7.2500     -0.00000
      9       7.4109     -0.00000
     10       9.9080      0.00000
     11       9.9302      0.00000
     12      10.8965      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4152      0.00000
     12       8.5500      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4152      0.00000
     12       8.5500      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4152      0.00000
     12       8.5500      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4152      0.00000
     12       8.5500      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4152      0.00000
     12       8.5500      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4152      0.00000
     12       8.5500      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0412     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0411     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0412     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0412     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0412     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0411     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.2331      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.2331      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.2331      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.2331      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.2331      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.2331      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5819      1.00000
      3      -2.2959      1.00000
      4      -2.2325      1.00000
      5      -0.5902      1.00000
      6       0.2611      1.00000
      7       2.5607      0.78277
      8       2.9094     -0.03232
      9       5.3779     -0.00000
     10       5.8840     -0.00000
     11       6.6865     -0.00000
     12       7.9047     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5819      1.00000
      3      -2.2959      1.00000
      4      -2.2325      1.00000
      5      -0.5902      1.00000
      6       0.2611      1.00000
      7       2.5607      0.78277
      8       2.9094     -0.03232
      9       5.3779     -0.00000
     10       5.8840     -0.00000
     11       6.6865     -0.00000
     12       7.9047     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5819      1.00000
      3      -2.2959      1.00000
      4      -2.2325      1.00000
      5      -0.5902      1.00000
      6       0.2611      1.00000
      7       2.5607      0.78277
      8       2.9094     -0.03232
      9       5.3779     -0.00000
     10       5.8840     -0.00000
     11       6.6865     -0.00000
     12       7.9047     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3406      1.00000
      2      -7.9770      1.00000
      3      -5.9896      1.00000
      4      -3.1485      1.00000
      5       0.1135      1.00000
      6       3.8868     -0.00000
      7       6.0313     -0.00000
      8       6.9667     -0.00000
      9       7.0148     -0.00000
     10       8.0638     -0.00000
     11       8.1566      0.00000
     12       8.4096      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3406      1.00000
      2      -7.9770      1.00000
      3      -5.9896      1.00000
      4      -3.1485      1.00000
      5       0.1135      1.00000
      6       3.8868     -0.00000
      7       6.0313     -0.00000
      8       6.9667     -0.00000
      9       7.0148     -0.00000
     10       8.0638     -0.00000
     11       8.1566      0.00000
     12       8.4096      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3406      1.00000
      2      -7.9770      1.00000
      3      -5.9896      1.00000
      4      -3.1485      1.00000
      5       0.1135      1.00000
      6       3.8868     -0.00000
      7       6.0313     -0.00000
      8       6.9667     -0.00000
      9       7.0148     -0.00000
     10       8.0638     -0.00000
     11       8.1566      0.00000
     12       8.4096      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7603      1.00000
      2      -6.3905      1.00000
      3      -4.3984      1.00000
      4      -1.5636      1.00000
      5       1.5917      1.00000
      6       3.9919     -0.00000
      7       4.2256     -0.00000
      8       5.2816     -0.00000
      9       5.5009     -0.00000
     10       6.0249     -0.00000
     11       7.0954     -0.00000
     12       7.4099     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7603      1.00000
      2      -6.3905      1.00000
      3      -4.3984      1.00000
      4      -1.5636      1.00000
      5       1.5917      1.00000
      6       3.9919     -0.00000
      7       4.2256     -0.00000
      8       5.2816     -0.00000
      9       5.5009     -0.00000
     10       6.0249     -0.00000
     11       7.0954     -0.00000
     12       7.4099     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7603      1.00000
      2      -6.3905      1.00000
      3      -4.3984      1.00000
      4      -1.5636      1.00000
      5       1.5917      1.00000
      6       3.9919     -0.00000
      7       4.2256     -0.00000
      8       5.2816     -0.00000
      9       5.5009     -0.00000
     10       6.0249     -0.00000
     11       7.0954     -0.00000
     12       7.4099     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9530      1.00000
      2      -2.8974      1.00000
      3      -1.6158      1.00000
      4      -1.5707      1.00000
      5       0.0520      1.00000
      6       0.9182      1.00000
      7       2.7063      0.21044
      8       2.9544     -0.02252
      9       3.8818     -0.00000
     10       4.7816     -0.00000
     11       6.1621     -0.00000
     12       6.4743     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9530      1.00000
      2      -2.8974      1.00000
      3      -1.6158      1.00000
      4      -1.5707      1.00000
      5       0.0520      1.00000
      6       0.9182      1.00000
      7       2.7063      0.21045
      8       2.9544     -0.02252
      9       3.8818     -0.00000
     10       4.7816     -0.00000
     11       6.1621     -0.00000
     12       6.4743     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9530      1.00000
      2      -2.8974      1.00000
      3      -1.6158      1.00000
      4      -1.5707      1.00000
      5       0.0520      1.00000
      6       0.9182      1.00000
      7       2.7063      0.21045
      8       2.9544     -0.02252
      9       3.8818     -0.00000
     10       4.7816     -0.00000
     11       6.1621     -0.00000
     12       6.4743     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7210      1.00000
      2      -4.3474      1.00000
      3      -2.3691      1.00000
      4       0.3019      1.00000
      5       1.6013      1.00000
      6       1.9014      1.00000
      7       3.0152     -0.01070
      8       3.2980     -0.00001
      9       4.0234     -0.00000
     10       4.8028     -0.00000
     11       5.6215     -0.00000
     12       7.2694     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7210      1.00000
      2      -4.3474      1.00000
      3      -2.3691      1.00000
      4       0.3019      1.00000
      5       1.6013      1.00000
      6       1.9014      1.00000
      7       3.0152     -0.01070
      8       3.2980     -0.00001
      9       4.0234     -0.00000
     10       4.8028     -0.00000
     11       5.6215     -0.00000
     12       7.2694     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7210      1.00000
      2      -4.3474      1.00000
      3      -2.3691      1.00000
      4       0.3019      1.00000
      5       1.6013      1.00000
      6       1.9014      1.00000
      7       3.0152     -0.01070
      8       3.2980     -0.00001
      9       4.0234     -0.00000
     10       4.8028     -0.00000
     11       5.6215     -0.00000
     12       7.2694     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2246      1.00000
      2      -1.8707      1.00000
      3      -0.2750      1.00000
      4      -0.2150      1.00000
      5      -0.0654      1.00000
      6       0.9416      1.00000
      7       1.2702      1.00000
      8       2.4767      0.98404
      9       3.6850     -0.00000
     10       3.8179     -0.00000
     11       5.9770     -0.00000
     12       6.2166     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2246      1.00000
      2      -1.8707      1.00000
      3      -0.2750      1.00000
      4      -0.2150      1.00000
      5      -0.0654      1.00000
      6       0.9416      1.00000
      7       1.2702      1.00000
      8       2.4767      0.98404
      9       3.6850     -0.00000
     10       3.8179     -0.00000
     11       5.9766     -0.00000
     12       6.2194     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2246      1.00000
      2      -1.8707      1.00000
      3      -0.2750      1.00000
      4      -0.2150      1.00000
      5      -0.0654      1.00000
      6       0.9416      1.00000
      7       1.2702      1.00000
      8       2.4767      0.98404
      9       3.6850     -0.00000
     10       3.8179     -0.00000
     11       5.9775     -0.00000
     12       6.2147     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7642      1.00000
      3      -0.5075      1.00000
      4      -0.4853      1.00000
      5      -0.3044      1.00000
      6       0.7213      1.00000
      7       1.4339      1.00000
      8       1.7840      1.00000
      9       3.4575     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7642      1.00000
      3      -0.5075      1.00000
      4      -0.4853      1.00000
      5      -0.3044      1.00000
      6       0.7213      1.00000
      7       1.4339      1.00000
      8       1.7840      1.00000
      9       3.4575     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7642      1.00000
      3      -0.5075      1.00000
      4      -0.4853      1.00000
      5      -0.3044      1.00000
      6       0.7213      1.00000
      7       1.4339      1.00000
      8       1.7840      1.00000
      9       3.4575     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000
 Fermi energy:         2.6319706378

 spin component 2

 k-point     1 :       0.0000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.3671      1.00000
      2     -10.0112      1.00000
      3      -8.0354      1.00000
      4      -5.2250      1.00000
      5      -1.9151      1.00000
      6       2.0386      1.00011
      7       4.5144     -0.00000
      8       6.5229     -0.00000
      9       6.7139     -0.00000
     10      10.8419      0.00000
     11      10.8647      0.00000
     12      15.5310      0.00000

 k-point     2 :       0.0500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.2921      1.00000
      2      -9.9359      1.00000
      3      -7.9596      1.00000
      4      -5.1476      1.00000
      5      -1.8390      1.00000
      6       2.1143      1.00077
      7       4.5787     -0.00000
      8       6.5856     -0.00000
      9       6.7753     -0.00000
     10      10.8893      0.00000
     11      10.9204      0.00000
     12      13.9329      0.00000

 k-point     3 :       0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2921      1.00000
      2      -9.9359      1.00000
      3      -7.9596      1.00000
      4      -5.1476      1.00000
      5      -1.8390      1.00000
      6       2.1143      1.00077
      7       4.5787     -0.00000
      8       6.5856     -0.00000
      9       6.7753     -0.00000
     10      10.8893      0.00000
     11      10.9204      0.00000
     12      13.9329      0.00000

 k-point     4 :       0.0000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.2921      1.00000
      2      -9.9359      1.00000
      3      -7.9596      1.00000
      4      -5.1476      1.00000
      5      -1.8390      1.00000
      6       2.1143      1.00077
      7       4.5787     -0.00000
      8       6.5856     -0.00000
      9       6.7753     -0.00000
     10      10.8893      0.00000
     11      10.9204      0.00000
     12      13.9329      0.00000

 k-point     5 :       0.1000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -11.0671      1.00000
      2      -9.7101      1.00000
      3      -7.7324      1.00000
      4      -4.9157      1.00000
      5      -1.6111      1.00000
      6       2.3379      1.02896
      7       4.7704     -0.00000
      8       6.7720     -0.00000
      9       6.9569     -0.00000
     10      10.9740      0.00000
     11      11.0805      0.00000
     12      11.9667      0.00000

 k-point     6 :       0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0671      1.00000
      2      -9.7101      1.00000
      3      -7.7324      1.00000
      4      -4.9157      1.00000
      5      -1.6111      1.00000
      6       2.3379      1.02896
      7       4.7704     -0.00000
      8       6.7720     -0.00000
      9       6.9569     -0.00000
     10      10.9740      0.00000
     11      11.0805      0.00000
     12      11.9667      0.00000

 k-point     7 :       0.0000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.0671      1.00000
      2      -9.7101      1.00000
      3      -7.7324      1.00000
      4      -4.9157      1.00000
      5      -1.6111      1.00000
      6       2.3379      1.02896
      7       4.7704     -0.00000
      8       6.7720     -0.00000
      9       6.9569     -0.00000
     10      10.9740      0.00000
     11      11.0805      0.00000
     12      11.9667      0.00000

 k-point     8 :       0.1500   -0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3337      1.00000
      3      -7.3537      1.00000
      4      -4.5299      1.00000
      5      -1.2326      1.00000
      6       2.6999      0.22993
      7       5.0850     -0.00000
      8       7.0720     -0.00000
      9       7.2462     -0.00000
     10       9.7570      0.00000
     11      10.6865      0.00000
     12      11.5302      0.00000

 k-point     9 :       0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3337      1.00000
      3      -7.3537      1.00000
      4      -4.5299      1.00000
      5      -1.2326      1.00000
      6       2.6999      0.22993
      7       5.0850     -0.00000
      8       7.0720     -0.00000
      9       7.2462     -0.00000
     10       9.7570      0.00000
     11      10.6865      0.00000
     12      11.4524      0.00000

 k-point    10 :       0.0000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.6921      1.00000
      2      -9.3337      1.00000
      3      -7.3537      1.00000
      4      -4.5299      1.00000
      5      -1.2326      1.00000
      6       2.6999      0.22993
      7       5.0850     -0.00000
      8       7.0720     -0.00000
      9       7.2462     -0.00000
     10       9.7570      0.00000
     11      10.6865      0.00000
     12      11.9589      0.00000

 k-point    11 :       0.2000    0.0000    0.0000
  band No.  band energies     occupation 
      1     -10.1668      1.00000
      2      -8.8064      1.00000
      3      -6.8233      1.00000
      4      -3.9912      1.00000
      5      -0.7058      1.00000
      6       3.1828     -0.00035
      7       5.5028     -0.00000
      8       7.2078     -0.00000
      9       7.5860     -0.00000
     10       8.1076      0.00000
     11       8.7594      0.00000
     12      10.4279      0.00000

 k-point    12 :       0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1668      1.00000
      2      -8.8064      1.00000
      3      -6.8233      1.00000
      4      -3.9912      1.00000
      5      -0.7058      1.00000
      6       3.1828     -0.00035
      7       5.5028     -0.00000
      8       7.2078     -0.00000
      9       7.5860     -0.00000
     10       8.1076      0.00000
     11       8.7594      0.00000
     12      10.4279      0.00000

 k-point    13 :       0.0000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.1668      1.00000
      2      -8.8064      1.00000
      3      -6.8233      1.00000
      4      -3.9912      1.00000
      5      -0.7058      1.00000
      6       3.1828     -0.00035
      7       5.5028     -0.00000
      8       7.2078     -0.00000
      9       7.5860     -0.00000
     10       8.1076      0.00000
     11       8.7594      0.00000
     12      10.4279      0.00000

 k-point    14 :       0.2500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -9.4909      1.00000
      2      -8.1278      1.00000
      3      -6.1411      1.00000
      4      -3.3015      1.00000
      5      -0.0368      1.00000
      6       3.7225     -0.00000
      7       5.3971     -0.00000
      8       6.2522     -0.00000
      9       6.7454     -0.00000
     10       8.1007      0.00000
     11       8.2411      0.00000
     12       8.6135      0.00000

 k-point    15 :       0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4909      1.00000
      2      -8.1278      1.00000
      3      -6.1411      1.00000
      4      -3.3015      1.00000
      5      -0.0368      1.00000
      6       3.7225     -0.00000
      7       5.3971     -0.00000
      8       6.2522     -0.00000
      9       6.7454     -0.00000
     10       8.1007      0.00000
     11       8.2411      0.00000
     12       8.6135      0.00000

 k-point    16 :       0.0000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.4909      1.00000
      2      -8.1278      1.00000
      3      -6.1411      1.00000
      4      -3.3015      1.00000
      5      -0.0368      1.00000
      6       3.7225     -0.00000
      7       5.3971     -0.00000
      8       6.2522     -0.00000
      9       6.7454     -0.00000
     10       8.1007      0.00000
     11       8.2411      0.00000
     12       8.6135      0.00000

 k-point    17 :       0.3000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -8.6640      1.00000
      2      -7.2974      1.00000
      3      -5.3072      1.00000
      4      -2.4656      1.00000
      5       0.7485      1.00000
      6       3.2545     -0.00005
      7       4.5142     -0.00000
      8       5.0342     -0.00000
      9       6.4620     -0.00000
     10       6.9468     -0.00000
     11       8.7488      0.00000
     12       9.2112      0.00000

 k-point    18 :       0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6640      1.00000
      2      -7.2974      1.00000
      3      -5.3072      1.00000
      4      -2.4656      1.00000
      5       0.7485      1.00000
      6       3.2545     -0.00005
      7       4.5142     -0.00000
      8       5.0342     -0.00000
      9       6.4620     -0.00000
     10       6.9468     -0.00000
     11       8.7683      0.00000
     12       9.7756      0.00000

 k-point    19 :       0.0000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.6640      1.00000
      2      -7.2974      1.00000
      3      -5.3072      1.00000
      4      -2.4656      1.00000
      5       0.7485      1.00000
      6       3.2545     -0.00005
      7       4.5142     -0.00000
      8       5.0342     -0.00000
      9       6.4620     -0.00000
     10       6.9468     -0.00000
     11       8.7582      0.00000
     12       9.3589      0.00000

 k-point    20 :       0.3500    0.0000    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3146      1.00000
      3      -4.3230      1.00000
      4      -1.5034      1.00000
      5       1.1153      1.00000
      6       1.9697      1.00001
      7       2.9125     -0.03183
      8       4.6967     -0.00000
      9       5.5687     -0.00000
     10       7.2794     -0.00000
     11       7.6746     -0.00000
     12      10.2675      0.00000

 k-point    21 :       0.3500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3146      1.00000
      3      -4.3230      1.00000
      4      -1.5034      1.00000
      5       1.1153      1.00000
      6       1.9697      1.00001
      7       2.9125     -0.03183
      8       4.6967     -0.00000
      9       5.5687     -0.00000
     10       7.2794     -0.00000
     11       7.6746     -0.00000
     12      10.2782      0.00000

 k-point    22 :       0.0000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.6852      1.00000
      2      -6.3146      1.00000
      3      -4.3230      1.00000
      4      -1.5034      1.00000
      5       1.1153      1.00000
      6       1.9697      1.00001
      7       2.9125     -0.03183
      8       4.6967     -0.00000
      9       5.5687     -0.00000
     10       7.2794     -0.00000
     11       7.6746     -0.00000
     12      10.2784      0.00000

 k-point    23 :       0.4000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -6.5534      1.00000
      2      -5.1795      1.00000
      3      -3.1956      1.00000
      4      -0.7647      1.00000
      5      -0.2257      1.00000
      6       1.0709      1.00000
      7       2.8559     -0.03347
      8       3.0986     -0.00236
      9       5.5788     -0.00000
     10       6.5516     -0.00000
     11       8.3011      0.00000
     12       9.3945      0.00000

 k-point    24 :       0.4000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5534      1.00000
      2      -5.1795      1.00000
      3      -3.1956      1.00000
      4      -0.7647      1.00000
      5      -0.2257      1.00000
      6       1.0709      1.00000
      7       2.8559     -0.03347
      8       3.0986     -0.00236
      9       5.5788     -0.00000
     10       6.5516     -0.00000
     11       8.3013      0.00000
     12       9.5473      0.00000

 k-point    25 :       0.0000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -6.5534      1.00000
      2      -5.1795      1.00000
      3      -3.1956      1.00000
      4      -0.7647      1.00000
      5      -0.2257      1.00000
      6       1.0709      1.00000
      7       2.8559     -0.03347
      8       3.0986     -0.00236
      9       5.5788     -0.00000
     10       6.5516     -0.00000
     11       8.3013      0.00000
     12       9.5486      0.00000

 k-point    26 :       0.4500   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -5.2688      1.00000
      2      -3.8965      1.00000
      3      -2.2630      1.00000
      4      -1.9812      1.00000
      5      -0.8614      1.00000
      6       0.9083      1.00000
      7       1.5238      1.00000
      8       4.0032     -0.00000
      9       4.1919     -0.00000
     10       6.8822     -0.00000
     11       7.6010     -0.00000
     12       9.8007      0.00000

 k-point    27 :       0.4500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2688      1.00000
      2      -3.8965      1.00000
      3      -2.2630      1.00000
      4      -1.9812      1.00000
      5      -0.8614      1.00000
      6       0.9083      1.00000
      7       1.5238      1.00000
      8       4.0032     -0.00000
      9       4.1919     -0.00000
     10       6.8822     -0.00000
     11       7.6010     -0.00000
     12       9.8007      0.00000

 k-point    28 :       0.0000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.2688      1.00000
      2      -3.8965      1.00000
      3      -2.2630      1.00000
      4      -1.9812      1.00000
      5      -0.8614      1.00000
      6       0.9083      1.00000
      7       1.5238      1.00000
      8       4.0032     -0.00000
      9       4.1919     -0.00000
     10       6.8822     -0.00000
     11       7.6010     -0.00000
     12       9.8007      0.00000

 k-point    29 :       0.5000   -0.0000    0.0000
  band No.  band energies     occupation 
      1      -3.8570      1.00000
      2      -3.8106      1.00000
      3      -2.5236      1.00000
      4      -2.4535      1.00000
      5      -0.8065      1.00000
      6       0.0356      1.00000
      7       2.3637      1.03363
      8       2.7232      0.15654
      9       5.2684     -0.00000
     10       5.7035     -0.00000
     11       8.4678      0.00000
     12       9.3899      0.00000

 k-point    30 :       0.5000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8570      1.00000
      2      -3.8106      1.00000
      3      -2.5236      1.00000
      4      -2.4535      1.00000
      5      -0.8065      1.00000
      6       0.0356      1.00000
      7       2.3637      1.03363
      8       2.7232      0.15654
      9       5.2683     -0.00000
     10       5.7035     -0.00000
     11       8.4678      0.00000
     12       9.6868      0.00000

 k-point    31 :       0.0000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -3.8570      1.00000
      2      -3.8106      1.00000
      3      -2.5236      1.00000
      4      -2.4535      1.00000
      5      -0.8065      1.00000
      6       0.0356      1.00000
      7       2.3637      1.03363
      8       2.7232      0.15654
      9       5.2684     -0.00000
     10       5.7035     -0.00000
     11       8.4678      0.00000
     12       9.0359      0.00000

 k-point    32 :       0.1000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1421      1.00000
      2      -9.7854      1.00000
      3      -7.8082      1.00000
      4      -4.9930      1.00000
      5      -1.6870      1.00000
      6       2.2639      1.01294
      7       4.7067     -0.00000
      8       6.7102     -0.00000
      9       6.8969     -0.00000
     10      10.9715      0.00000
     11      11.0254      0.00000
     12      12.9343      0.00000

 k-point    33 :       0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -11.1421      1.00000
      2      -9.7854      1.00000
      3      -7.8082      1.00000
      4      -4.9930      1.00000
      5      -1.6870      1.00000
      6       2.2639      1.01294
      7       4.7067     -0.00000
      8       6.7102     -0.00000
      9       6.8969     -0.00000
     10      10.9715      0.00000
     11      11.0254      0.00000
     12      12.9355      0.00000

 k-point    34 :      -0.0500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -11.1421      1.00000
      2      -9.7854      1.00000
      3      -7.8082      1.00000
      4      -4.9930      1.00000
      5      -1.6870      1.00000
      6       2.2639      1.01294
      7       4.7067     -0.00000
      8       6.7102     -0.00000
      9       6.8969     -0.00000
     10      10.9715      0.00000
     11      11.0254      0.00000
     12      12.9420      0.00000

 k-point    35 :       0.1500    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79440
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1694      0.00000
     12      11.3805      0.00000

 k-point    36 :       0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79440
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1694      0.00000
     12      11.3805      0.00000

 k-point    37 :      -0.0500    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79440
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1694      0.00000
     12      11.3805      0.00000

 k-point    38 :       0.1000   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79440
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1694      0.00000
     12      11.3805      0.00000

 k-point    39 :      -0.0500   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79440
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1694      0.00000
     12      11.3805      0.00000

 k-point    40 :      -0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.8421      1.00000
      2      -9.4843      1.00000
      3      -7.5052      1.00000
      4      -4.6841      1.00000
      5      -1.3838      1.00000
      6       2.5568      0.79440
      7       4.9602     -0.00000
      8       6.9554     -0.00000
      9       7.1340     -0.00000
     10      10.7071      0.00000
     11      11.1694      0.00000
     12      11.3805      0.00000

 k-point    41 :       0.2000    0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    42 :       0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    43 :      -0.0500    0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    44 :       0.1500   -0.0500    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    45 :      -0.0500   -0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    46 :      -0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1     -10.3919      1.00000
      2      -9.0324      1.00000
      3      -7.0506      1.00000
      4      -4.2219      1.00000
      5      -0.9310      1.00000
      6       2.9803     -0.01676
      7       5.3306     -0.00000
      8       7.2857     -0.00000
      9       7.4541     -0.00000
     10       8.8481      0.00000
     11       9.7889      0.00000
     12      11.0445      0.00000

 k-point    47 :       0.2500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    48 :       0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    49 :      -0.0500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    50 :       0.2000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    51 :      -0.0500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    52 :      -0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.7914      1.00000
      2      -8.4295      1.00000
      3      -6.4444      1.00000
      4      -3.6076      1.00000
      5      -0.3322      1.00000
      6       3.5067     -0.00000
      7       5.7386     -0.00000
      8       6.6181     -0.00000
      9       7.7219     -0.00000
     10       7.9024     -0.00000
     11       8.1609      0.00000
     12       9.4926      0.00000

 k-point    53 :       0.3000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       8.9386      0.00000

 k-point    54 :       0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       8.9389      0.00000

 k-point    55 :      -0.0500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       8.9375      0.00000

 k-point    56 :       0.2500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       8.9377      0.00000

 k-point    57 :      -0.0500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       8.9386      0.00000

 k-point    58 :      -0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.0400      1.00000
      2      -7.6750      1.00000
      3      -5.6863      1.00000
      4      -2.8441      1.00000
      5       0.4008      1.00000
      6       3.8668     -0.00000
      7       4.7808     -0.00000
      8       5.8322     -0.00000
      9       6.5279     -0.00000
     10       7.5520     -0.00000
     11       8.4370      0.00000
     12       8.9363      0.00000

 k-point    59 :       0.3500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    60 :       0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    61 :      -0.0500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    62 :       0.3000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    63 :      -0.0500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    64 :      -0.3500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -8.1371      1.00000
      2      -6.7684      1.00000
      3      -4.7769      1.00000
      4      -1.9409      1.00000
      5       1.1833      1.00000
      6       2.4885      0.96646
      7       3.8190     -0.00000
      8       5.2045     -0.00000
      9       5.6611     -0.00000
     10       7.2905     -0.00000
     11       8.1330      0.00000
     12       8.9416      0.00000

 k-point    65 :       0.4000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7633      0.00000

 k-point    66 :       0.3500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7633      0.00000

 k-point    67 :      -0.0500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7633      0.00000

 k-point    68 :       0.3500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7633      0.00000

 k-point    69 :      -0.0500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7633      0.00000

 k-point    70 :      -0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -7.0818      1.00000
      2      -5.7092      1.00000
      3      -3.7196      1.00000
      4      -0.9528      1.00000
      5       0.4459      1.00000
      6       1.8424      1.00000
      7       2.6121      0.58500
      8       3.8705     -0.00000
      9       5.9860     -0.00000
     10       6.5430     -0.00000
     11       8.0919      0.00000
     12       8.7633      0.00000

 k-point    71 :       0.4500    0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    72 :       0.4000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    73 :      -0.0500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    74 :       0.4000   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    75 :      -0.0500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    76 :      -0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.8734      1.00000
      2      -4.4992      1.00000
      3      -2.5317      1.00000
      4      -1.3901      1.00000
      5      -0.2228      1.00000
      6       0.7475      1.00000
      7       2.1779      1.00305
      8       3.6185     -0.00000
      9       4.8425     -0.00000
     10       7.0347     -0.00000
     11       7.6522     -0.00000
     12       8.5433      0.00000

 k-point    77 :       0.5000    0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    78 :       0.4500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    79 :      -0.0500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    80 :       0.4500   -0.0500    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    81 :      -0.0500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    82 :       0.5000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5130      1.00000
      2      -3.1485      1.00000
      3      -3.0059      1.00000
      4      -1.7664      1.00000
      5      -1.0813      1.00000
      6       0.5062      1.00000
      7       1.9128      1.00000
      8       3.3307     -0.00000
      9       4.8342     -0.00000
     10       6.2459     -0.00000
     11       7.9839     -0.00000
     12       8.4857      0.00000

 k-point    83 :       0.2000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1078      1.00000
      3      -7.1264      1.00000
      4      -4.2988      1.00000
      5      -1.0062      1.00000
      6       2.9116     -0.03182
      7       5.2712     -0.00000
      8       7.2500     -0.00000
      9       7.4109     -0.00000
     10       9.9081      0.00000
     11       9.9301      0.00000
     12      10.8616      0.00000

 k-point    84 :       0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1078      1.00000
      3      -7.1264      1.00000
      4      -4.2988      1.00000
      5      -1.0062      1.00000
      6       2.9116     -0.03182
      7       5.2712     -0.00000
      8       7.2500     -0.00000
      9       7.4109     -0.00000
     10       9.9081      0.00000
     11       9.9301      0.00000
     12      10.8453      0.00000

 k-point    85 :      -0.1000    0.1000    0.0000
  band No.  band energies     occupation 
      1     -10.4670      1.00000
      2      -9.1078      1.00000
      3      -7.1264      1.00000
      4      -4.2988      1.00000
      5      -1.0062      1.00000
      6       2.9116     -0.03182
      7       5.2712     -0.00000
      8       7.2500     -0.00000
      9       7.4109     -0.00000
     10       9.9080      0.00000
     11       9.9301      0.00000
     12      10.8481      0.00000

 k-point    86 :       0.2500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    87 :       0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    88 :      -0.1000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    89 :       0.1500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    90 :      -0.1000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    91 :      -0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.9415      1.00000
      2      -8.5803      1.00000
      3      -6.5960      1.00000
      4      -3.7609      1.00000
      5      -0.4808      1.00000
      6       3.3856     -0.00000
      7       5.6829     -0.00000
      8       7.4004     -0.00000
      9       7.6946     -0.00000
     10       8.2743      0.00000
     11       8.9070      0.00000
     12       9.2134      0.00000

 k-point    92 :       0.3000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4173      0.00000
     12       8.5511      0.00000

 k-point    93 :       0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4173      0.00000
     12       8.5511      0.00000

 k-point    94 :      -0.1000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4173      0.00000
     12       8.5511      0.00000

 k-point    95 :       0.2000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4173      0.00000
     12       8.5511      0.00000

 k-point    96 :      -0.1000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4173      0.00000
     12       8.5511      0.00000

 k-point    97 :      -0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -9.2655      1.00000
      2      -7.9015      1.00000
      3      -5.9138      1.00000
      4      -3.0723      1.00000
      5       0.1859      1.00000
      6       3.9170     -0.00000
      7       5.5865     -0.00000
      8       6.4232     -0.00000
      9       6.9264     -0.00000
     10       7.9907     -0.00000
     11       8.4173      0.00000
     12       8.5511      0.00000

 k-point    98 :       0.3500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0412     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point    99 :       0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0411     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point   100 :      -0.1000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0412     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point   101 :       0.2500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0412     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point   102 :      -0.1000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0412     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point   103 :      -0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -8.4382      1.00000
      2      -7.0708      1.00000
      3      -5.0799      1.00000
      4      -2.2385      1.00000
      5       0.9671      1.00000
      6       3.4668     -0.00000
      7       4.7053     -0.00000
      8       5.2003     -0.00000
      9       6.6348     -0.00000
     10       7.0411     -0.00000
     11       7.7395     -0.00000
     12       8.7632      0.00000

 k-point   104 :       0.4000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.1898      0.00000

 k-point   105 :       0.3000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.1898      0.00000

 k-point   106 :      -0.1000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.1898      0.00000

 k-point   107 :       0.3000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.1898      0.00000

 k-point   108 :      -0.1000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.1898      0.00000

 k-point   109 :      -0.4000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -7.4589      1.00000
      2      -6.0877      1.00000
      3      -4.0962      1.00000
      4      -1.2801      1.00000
      5       1.3335      1.00000
      6       2.1839      1.00337
      7       3.1219     -0.00147
      8       4.8873     -0.00000
      9       5.6676     -0.00000
     10       7.0847     -0.00000
     11       7.4760     -0.00000
     12       8.1898      0.00000

 k-point   110 :       0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   111 :       0.3500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   112 :      -0.1000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   113 :       0.3500   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   114 :      -0.1000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   115 :      -0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -6.3265      1.00000
      2      -4.9526      1.00000
      3      -2.9703      1.00000
      4      -0.5459      1.00000
      5      -0.0027      1.00000
      6       1.2897      1.00000
      7       3.0546     -0.00547
      8       3.3035     -0.00001
      9       5.6611     -0.00000
     10       6.5021     -0.00000
     11       7.1618     -0.00000
     12       8.3022      0.00000

 k-point   116 :       0.5000    0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   117 :       0.4000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   118 :      -0.1000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   119 :       0.4000   -0.1000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   120 :      -0.1000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   121 :       0.5000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -5.0413      1.00000
      2      -3.6701      1.00000
      3      -2.0366      1.00000
      4      -1.7597      1.00000
      5      -0.6393      1.00000
      6       1.1246      1.00000
      7       1.7324      1.00000
      8       4.1575     -0.00000
      9       4.3816     -0.00000
     10       6.5610     -0.00000
     11       7.0746     -0.00000
     12       7.8302     -0.00000

 k-point   122 :      -0.4500    0.1000    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5819      1.00000
      3      -2.2959      1.00000
      4      -2.2325      1.00000
      5      -0.5902      1.00000
      6       0.2611      1.00000
      7       2.5607      0.78277
      8       2.9094     -0.03232
      9       5.3779     -0.00000
     10       5.8840     -0.00000
     11       6.6865     -0.00000
     12       7.9047     -0.00000

 k-point   123 :       0.4500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5819      1.00000
      3      -2.2959      1.00000
      4      -2.2325      1.00000
      5      -0.5902      1.00000
      6       0.2611      1.00000
      7       2.5607      0.78277
      8       2.9094     -0.03232
      9       5.3779     -0.00000
     10       5.8840     -0.00000
     11       6.6865     -0.00000
     12       7.9047     -0.00000

 k-point   124 :      -0.1000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -3.6307      1.00000
      2      -3.5819      1.00000
      3      -2.2959      1.00000
      4      -2.2325      1.00000
      5      -0.5902      1.00000
      6       0.2611      1.00000
      7       2.5607      0.78277
      8       2.9094     -0.03232
      9       5.3779     -0.00000
     10       5.8840     -0.00000
     11       6.6865     -0.00000
     12       7.9047     -0.00000

 k-point   125 :       0.3000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3406      1.00000
      2      -7.9770      1.00000
      3      -5.9896      1.00000
      4      -3.1485      1.00000
      5       0.1135      1.00000
      6       3.8868     -0.00000
      7       6.0313     -0.00000
      8       6.9667     -0.00000
      9       7.0148     -0.00000
     10       8.0638     -0.00000
     11       8.1566      0.00000
     12       8.4088      0.00000

 k-point   126 :       0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -9.3406      1.00000
      2      -7.9770      1.00000
      3      -5.9896      1.00000
      4      -3.1485      1.00000
      5       0.1135      1.00000
      6       3.8868     -0.00000
      7       6.0313     -0.00000
      8       6.9667     -0.00000
      9       7.0148     -0.00000
     10       8.0638     -0.00000
     11       8.1566      0.00000
     12       8.4088      0.00000

 k-point   127 :      -0.1500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -9.3406      1.00000
      2      -7.9770      1.00000
      3      -5.9896      1.00000
      4      -3.1485      1.00000
      5       0.1135      1.00000
      6       3.8868     -0.00000
      7       6.0313     -0.00000
      8       6.9667     -0.00000
      9       7.0148     -0.00000
     10       8.0638     -0.00000
     11       8.1566      0.00000
     12       8.4088      0.00000

 k-point   128 :       0.3500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   129 :       0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   130 :      -0.1500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   131 :       0.2000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   132 :      -0.1500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   133 :      -0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -8.5887      1.00000
      2      -7.2220      1.00000
      3      -5.2315      1.00000
      4      -2.3885      1.00000
      5       0.8387      1.00000
      6       4.2485     -0.00000
      7       5.1051     -0.00000
      8       6.0748     -0.00000
      9       6.3832     -0.00000
     10       7.0128     -0.00000
     11       7.3722     -0.00000
     12       8.0574     -0.00000

 k-point   134 :       0.4000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   135 :       0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   136 :      -0.1500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   137 :       0.2500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   138 :      -0.1500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   139 :      -0.4000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -7.6850      1.00000
      2      -6.3148      1.00000
      3      -4.3228      1.00000
      4      -1.4916      1.00000
      5       1.6087      1.00000
      6       2.9168     -0.03095
      7       4.2261     -0.00000
      8       5.1886     -0.00000
      9       5.9499     -0.00000
     10       6.0683     -0.00000
     11       7.0787     -0.00000
     12       7.6994     -0.00000

 k-point   140 :       0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   141 :       0.3000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   142 :      -0.1500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   143 :       0.3000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   144 :      -0.1500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   145 :      -0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -6.6285      1.00000
      2      -5.2553      1.00000
      3      -3.2675      1.00000
      4      -0.5150      1.00000
      5       0.8884      1.00000
      6       2.2638      1.01273
      7       3.0109     -0.01114
      8       4.2503     -0.00000
      9       5.0953     -0.00000
     10       6.2574     -0.00000
     11       6.6972     -0.00000
     12       7.3751     -0.00000

 k-point   146 :       0.5000    0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   147 :       0.3500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   148 :      -0.1500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   149 :       0.3500   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   150 :      -0.1500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   151 :       0.5000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -5.4189      1.00000
      2      -4.0458      1.00000
      3      -2.0844      1.00000
      4      -0.9420      1.00000
      5       0.2118      1.00000
      6       1.1763      1.00000
      7       2.5818      0.70460
      8       3.9303     -0.00000
      9       4.7628     -0.00000
     10       5.4395     -0.00000
     11       6.4572     -0.00000
     12       7.6781     -0.00000

 k-point   152 :      -0.4500    0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   153 :       0.4000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   154 :      -0.1500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   155 :       0.4000   -0.1500    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   156 :      -0.1500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   157 :       0.4500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -4.0580      1.00000
      2      -2.6982      1.00000
      3      -2.5511      1.00000
      4      -1.3243      1.00000
      5      -0.6393      1.00000
      6       0.9437      1.00000
      7       2.2931      1.01871
      8       3.6045     -0.00000
      9       4.7234     -0.00000
     10       5.4536     -0.00000
     11       6.2324     -0.00000
     12       6.8378     -0.00000

 k-point   158 :       0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7603      1.00000
      2      -6.3905      1.00000
      3      -4.3984      1.00000
      4      -1.5636      1.00000
      5       1.5917      1.00000
      6       3.9919     -0.00000
      7       4.2256     -0.00000
      8       5.2816     -0.00000
      9       5.5009     -0.00000
     10       6.0249     -0.00000
     11       7.0954     -0.00000
     12       7.4099     -0.00000

 k-point   159 :       0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -7.7603      1.00000
      2      -6.3905      1.00000
      3      -4.3984      1.00000
      4      -1.5636      1.00000
      5       1.5917      1.00000
      6       3.9919     -0.00000
      7       4.2256     -0.00000
      8       5.2816     -0.00000
      9       5.5009     -0.00000
     10       6.0249     -0.00000
     11       7.0954     -0.00000
     12       7.4099     -0.00000

 k-point   160 :      -0.2000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -7.7603      1.00000
      2      -6.3905      1.00000
      3      -4.3984      1.00000
      4      -1.5636      1.00000
      5       1.5917      1.00000
      6       3.9919     -0.00000
      7       4.2256     -0.00000
      8       5.2816     -0.00000
      9       5.5009     -0.00000
     10       6.0249     -0.00000
     11       7.0954     -0.00000
     12       7.4099     -0.00000

 k-point   161 :       0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   162 :       0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   163 :      -0.2000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   164 :       0.2500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   165 :      -0.2000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   166 :      -0.4500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -6.7794      1.00000
      2      -5.4067      1.00000
      3      -3.4171      1.00000
      4      -0.6215      1.00000
      5       1.9567      1.00001
      6       2.7441      0.09958
      7       3.7083     -0.00000
      8       3.7928     -0.00000
      9       4.9010     -0.00000
     10       5.5641     -0.00000
     11       6.5654     -0.00000
     12       7.0151     -0.00000

 k-point   167 :       0.5000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   168 :       0.3000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   169 :      -0.2000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   170 :       0.3000   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   171 :      -0.2000    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   172 :       0.5000   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -5.6455      1.00000
      2      -4.2719      1.00000
      3      -2.2969      1.00000
      4       0.1059      1.00000
      5       0.6431      1.00000
      6       1.9087      1.00000
      7       3.1310     -0.00120
      8       3.6570     -0.00000
      9       4.0438     -0.00000
     10       4.8219     -0.00000
     11       6.3816     -0.00000
     12       6.9129     -0.00000

 k-point   173 :      -0.4500    0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   174 :       0.3500   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   175 :      -0.2000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   176 :       0.3500   -0.2000    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   177 :      -0.2000    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   178 :       0.4500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -4.3592      1.00000
      2      -2.9920      1.00000
      3      -1.3603      1.00000
      4      -1.0991      1.00000
      5       0.0218      1.00000
      6       1.7265      1.00000
      7       2.2455      1.00986
      8       3.0559     -0.00534
      9       4.3292     -0.00000
     10       5.0825     -0.00000
     11       5.3359     -0.00000
     12       6.5275     -0.00000

 k-point   179 :      -0.4000    0.2000    0.0000
  band No.  band energies     occupation 
      1      -2.9530      1.00000
      2      -2.8974      1.00000
      3      -1.6158      1.00000
      4      -1.5707      1.00000
      5       0.0520      1.00000
      6       0.9182      1.00000
      7       2.7063      0.21044
      8       2.9544     -0.02252
      9       3.8818     -0.00000
     10       4.7816     -0.00000
     11       6.1621     -0.00000
     12       6.4743     -0.00000

 k-point   180 :       0.4000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9530      1.00000
      2      -2.8974      1.00000
      3      -1.6158      1.00000
      4      -1.5707      1.00000
      5       0.0520      1.00000
      6       0.9182      1.00000
      7       2.7063      0.21045
      8       2.9544     -0.02252
      9       3.8818     -0.00000
     10       4.7816     -0.00000
     11       6.1621     -0.00000
     12       6.4743     -0.00000

 k-point   181 :      -0.2000    0.4000    0.0000
  band No.  band energies     occupation 
      1      -2.9530      1.00000
      2      -2.8974      1.00000
      3      -1.6158      1.00000
      4      -1.5707      1.00000
      5       0.0520      1.00000
      6       0.9182      1.00000
      7       2.7063      0.21044
      8       2.9544     -0.02252
      9       3.8818     -0.00000
     10       4.7816     -0.00000
     11       6.1621     -0.00000
     12       6.4743     -0.00000

 k-point   182 :       0.5000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7210      1.00000
      2      -4.3474      1.00000
      3      -2.3691      1.00000
      4       0.3019      1.00000
      5       1.6013      1.00000
      6       1.9014      1.00000
      7       3.0152     -0.01070
      8       3.2980     -0.00001
      9       4.0234     -0.00000
     10       4.8028     -0.00000
     11       5.6215     -0.00000
     12       7.2694     -0.00000

 k-point   183 :       0.2500    0.5000    0.0000
  band No.  band energies     occupation 
      1      -5.7210      1.00000
      2      -4.3474      1.00000
      3      -2.3691      1.00000
      4       0.3019      1.00000
      5       1.6013      1.00000
      6       1.9014      1.00000
      7       3.0152     -0.01070
      8       3.2980     -0.00001
      9       4.0234     -0.00000
     10       4.8028     -0.00000
     11       5.6215     -0.00000
     12       7.2694     -0.00000

 k-point   184 :      -0.2500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -5.7210      1.00000
      2      -4.3474      1.00000
      3      -2.3691      1.00000
      4       0.3019      1.00000
      5       1.6013      1.00000
      6       1.9014      1.00000
      7       3.0152     -0.01070
      8       3.2980     -0.00001
      9       4.0234     -0.00000
     10       4.8028     -0.00000
     11       5.6215     -0.00000
     12       7.2694     -0.00000

 k-point   185 :      -0.4500    0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   186 :       0.3000   -0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   187 :      -0.2500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   188 :       0.3000   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   189 :      -0.2500    0.4500    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   190 :       0.4500   -0.3000    0.0000
  band No.  band energies     occupation 
      1      -4.5100      1.00000
      2      -3.1407      1.00000
      3      -1.2017      1.00000
      4      -0.0517      1.00000
      5       1.0114      1.00000
      6       1.3672      1.00000
      7       2.0537      1.00016
      8       2.7997      0.00115
      9       3.6838     -0.00000
     10       4.9242     -0.00000
     11       5.0858     -0.00000
     12       6.3173     -0.00000

 k-point   191 :      -0.4000    0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   192 :       0.3500   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   193 :      -0.2500    0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   194 :       0.3500   -0.2500    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   195 :      -0.2500    0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   196 :       0.4000   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -3.1499      1.00000
      2      -1.8029      1.00000
      3      -1.6456      1.00000
      4      -0.4488      1.00000
      5       0.2183      1.00000
      6       1.2564      1.00000
      7       1.7519      1.00000
      8       2.3633      1.03351
      9       3.6873     -0.00000
     10       4.6208     -0.00000
     11       5.1520     -0.00000
     12       6.1530     -0.00000

 k-point   197 :      -0.4000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2246      1.00000
      2      -1.8707      1.00000
      3      -0.2750      1.00000
      4      -0.2150      1.00000
      5      -0.0654      1.00000
      6       0.9416      1.00000
      7       1.2702      1.00000
      8       2.4767      0.98404
      9       3.6850     -0.00000
     10       3.8179     -0.00000
     11       5.9768     -0.00000
     12       6.2194     -0.00000

 k-point   198 :       0.3000   -0.4000    0.0000
  band No.  band energies     occupation 
      1      -3.2246      1.00000
      2      -1.8707      1.00000
      3      -0.2750      1.00000
      4      -0.2150      1.00000
      5      -0.0654      1.00000
      6       0.9416      1.00000
      7       1.2702      1.00000
      8       2.4767      0.98404
      9       3.6850     -0.00000
     10       3.8179     -0.00000
     11       5.9769     -0.00000
     12       6.2204     -0.00000

 k-point   199 :      -0.3000    0.3000    0.0000
  band No.  band energies     occupation 
      1      -3.2246      1.00000
      2      -1.8707      1.00000
      3      -0.2750      1.00000
      4      -0.2150      1.00000
      5      -0.0654      1.00000
      6       0.9416      1.00000
      7       1.2702      1.00000
      8       2.4767      0.98404
      9       3.6850     -0.00000
     10       3.8179     -0.00000
     11       5.9764     -0.00000
     12       6.2185     -0.00000

 k-point   200 :      -0.3500    0.3000    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7642      1.00000
      3      -0.5075      1.00000
      4      -0.4853      1.00000
      5      -0.3044      1.00000
      6       0.7213      1.00000
      7       1.4339      1.00000
      8       1.7840      1.00000
      9       3.4575     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000

 k-point   201 :       0.3500   -0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7642      1.00000
      3      -0.5075      1.00000
      4      -0.4853      1.00000
      5      -0.3044      1.00000
      6       0.7213      1.00000
      7       1.4339      1.00000
      8       1.7840      1.00000
      9       3.4575     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000

 k-point   202 :      -0.3000    0.3500    0.0000
  band No.  band energies     occupation 
      1      -1.8292      1.00000
      2      -1.7642      1.00000
      3      -0.5075      1.00000
      4      -0.4853      1.00000
      5      -0.3044      1.00000
      6       0.7213      1.00000
      7       1.4339      1.00000
      8       1.7840      1.00000
      9       3.4575     -0.00000
     10       4.5833     -0.00000
     11       4.8571     -0.00000
     12       6.0313     -0.00000


--------------------------------------------------------------------------------------------------------


 soft charge-density along one line, spin component           1
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 soft charge-density along one line, spin component           2
         0         1         2         3         4         5         6         7         8         9
 total charge-density along one line
 
 pseudopotential strength for first ion, spin component:           1
  8.084  13.801  -0.000  -0.002  -0.000  -0.000  -0.006  -0.000
 13.801  23.554  -0.000  -0.003  -0.000  -0.000  -0.010  -0.000
 -0.000  -0.000   1.879   0.000   0.000   5.469   0.000   0.000
 -0.002  -0.003   0.000   1.880   0.000   0.000   5.472   0.000
 -0.000  -0.000   0.000   0.000   1.879   0.000   0.000   5.469
 -0.000  -0.000   5.469   0.000   0.000  15.775   0.000   0.000
 -0.006  -0.010   0.000   5.472   0.000   0.000  15.783   0.000
 -0.000  -0.000   0.000   0.000   5.469   0.000   0.000  15.775
 pseudopotential strength for first ion, spin component:           2
  8.084  13.801  -0.000  -0.002  -0.000  -0.000  -0.006  -0.000
 13.801  23.554  -0.000  -0.003  -0.000  -0.000  -0.010  -0.000
 -0.000  -0.000   1.879  -0.000   0.000   5.469  -0.000   0.000
 -0.002  -0.003  -0.000   1.880   0.000  -0.000   5.472   0.000
 -0.000  -0.000   0.000   0.000   1.879   0.000   0.000   5.469
 -0.000  -0.000   5.469  -0.000   0.000  15.775  -0.000   0.000
 -0.006  -0.010  -0.000   5.472   0.000  -0.000  15.783   0.000
 -0.000  -0.000   0.000   0.000   5.469   0.000   0.000  15.775
 total augmentation occupancy for first ion, spin component:           1
116.854 -62.408   0.000  -0.172  -0.000   0.000  -0.008   0.000
-62.408  33.330  -0.000   0.082   0.000  -0.000   0.006  -0.000
  0.000  -0.000   2.104   0.000  -0.000  -0.326  -0.000   0.000
 -0.172   0.082   0.000   1.665  -0.000  -0.000  -0.256   0.000
 -0.000   0.000  -0.000  -0.000   2.104   0.000   0.000  -0.326
  0.000  -0.000  -0.326  -0.000   0.000   0.051   0.000  -0.000
 -0.008   0.006  -0.000  -0.256   0.000   0.000   0.039  -0.000
  0.000  -0.000   0.000   0.000  -0.326  -0.000  -0.000   0.051
 total augmentation occupancy for first ion, spin component:           2
 -0.000   0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000
  0.000  -0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000
  0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000
  0.000  -0.000  -0.000  -0.000  -0.000   0.000   0.000   0.000
  0.000  -0.000   0.000  -0.000  -0.000  -0.000   0.000   0.000
 -0.000   0.000  -0.000   0.000  -0.000   0.000  -0.000   0.000
 -0.000   0.000   0.000   0.000   0.000  -0.000  -0.000  -0.000
 -0.000   0.000  -0.000   0.000   0.000   0.000  -0.000  -0.000


------------------------ aborting loop because EDIFF is reached ----------------------------------------


    FORLOC:  cpu time      0.0008: real time      0.0008
    FORHF :  cpu time   1051.4575: real time   1055.6150
    FORNL :  cpu time      0.2605: real time      0.2619
    FORCOR:  cpu time      1.1754: real time      1.1788
    OFIELD:  cpu time      0.0001: real time      0.0001

 VOLUME and BASIS-vectors are now :
 -----------------------------------------------------------------------------
  energy-cutoff  :      400.00
  volume of cell :      120.20
      direct lattice vectors                 reciprocal lattice vectors
     2.857459769  0.000000000  0.000000000     0.349961183 -0.202050183  0.000000000
     1.428729885  2.474632750  0.000000000     0.000000000  0.404100366  0.000000000
     0.000000000  0.000000000 16.999318395     0.000000000  0.000000000  0.058825888

  length of vectors
     2.857459769  2.857459769 16.999318395     0.404100366  0.404100366  0.058825888


 FORCES acting on ions:
    Electron-Ion                     Ewald-Force                    Non-Local-Force
 -----------------------------------------------------------------------------------------------
   0.466E-06 0.263E-06 0.156E+03   0.412E-13 0.246E-13 -.155E+03   -.524E-06 -.179E-06 -.113E+01
   -.493E-06 0.874E-07 0.520E+02   -.141E-12 -.816E-13 -.520E+02   0.615E-06 -.722E-07 0.102E+00
   -.369E-05 0.178E-05 -.532E+02   0.144E-12 0.855E-13 0.531E+02   0.397E-05 -.183E-05 0.113E+00
   0.107E-05 -.294E-06 -.155E+03   -.437E-13 -.237E-13 0.154E+03   -.118E-05 0.212E-06 0.909E+00
 -----------------------------------------------------------------------------------------------
   -.238E-05 0.216E-05 -.228E-01   0.721E-15 0.484E-14 -.284E-13   0.288E-05 -.187E-05 -.212E-02
 
 
 POSITION                                       TOTAL-FORCE (eV/Angst)
 -----------------------------------------------------------------------------------
      0.00000      0.00000      0.00000        -0.000000     -0.000000     -0.098928
      1.42873      0.82488      2.33311        -0.000001     -0.000000      0.097364
      2.85746      1.64976      4.63908         0.000000      0.000000     -0.001731
      0.00000      0.00000      7.01504         0.000001      0.000000      0.003295
 -----------------------------------------------------------------------------------
    total drift:                                0.000001      0.000000     -0.024585


--------------------------------------------------------------------------------------------------------



  FREE ENERGIE OF THE ION-ELECTRON SYSTEM (eV)
  ---------------------------------------------------
  free  energy   TOTEN  =       -10.94946990 eV

  energy  without entropy=      -10.94979742  energy(sigma->0) =      -10.94957908
 
 d Force = 0.8263171E-05[-0.548E-05, 0.220E-04]  d Energy = 0.1726137E-04-0.900E-05
 d Force =-0.5779722E-01[-0.579E-01,-0.577E-01]  d Ewald  =-0.5779723E-01 0.392E-08


--------------------------------------------------------------------------------------------------------


    POTLOK:  cpu time      1.1771: real time      1.1805


--------------------------------------------------------------------------------------------------------


 Quasi-Newton relaxation of ions (Broydens 2nd method)
  g(Force)  = 0.668E-06   g(Stress)= 0.000E+00

 retain information from N=  1 steps
 eigenvalues of (default step * inverse Hessian matrix)
  average eigenvalue of G=   2.1727
 eigenvalue spectrum of G is  2.1727


--------------------------------------------------------------------------------------------------------


  
 reached required accuracy - stopping structural energy minimisation
 writing wavefunctions
     LOOP+:  cpu time  10096.0066: real time  10137.4603
    4ORBIT:  cpu time      0.0000: real time      0.0000

 total amount of memory used by VASP MPI-rank0    83265. kBytes
=======================================================================

   base      :      30000. kBytes
   nonl-proj :       7691. kBytes
   fftplans  :       3956. kBytes
   grid      :       2848. kBytes
   one-center:          6. kBytes
   HF        :          4. kBytes
   nonlr-proj:       1818. kBytes
   wavefun   :      34905. kBytes
   fock_wrk  :       2037. kBytes
 
  
  
 General timing and accounting informations for this job:
 ========================================================
  
                  Total CPU time used (sec):   103987.391
                            User time (sec):    95748.512
                          System time (sec):     8238.877
                         Elapsed time (sec):   104415.059
  
                   Maximum memory used (kb):      319212.
                   Average memory used (kb):          N/A
  
                          Minor page faults:       380772
                          Major page faults:          136
                 Voluntary context switches:          860
