Cu Bulk, HSE06-1/2x vdW-DF2, single pont
           1
     0.000000    2.050000    2.050000
     2.050000    0.000000    2.050000
     2.050000    2.050000    0.000000
   Al
     1
Direct configuration=     1
   0.00000000  0.00000000  0.00000000
