ATOMIC_SPECIES
H 1.008 ../../PP_ORB/H_ONCV_PBE-1.0.upf

NUMERICAL_ORBITAL
../../PP_ORB/H_gga_8au_100Ry_1s.orb

LATTICE_CONSTANT
1.8897270

LATTICE_VECTORS
 5.0000000  0.0000000   0.0000000
 0.0000000   5.0000000  0.0000000
  0.0000000  0.0000000  5.0000000

ATOMIC_POSITIONS
Direct

H
0.0
2
  0 0 0 1 1 1
  0.74 0 0 1 1 1