ATOMIC_SPECIES
Al 26.9815385 Al_ONCV_PBE-1.0.upf

LATTICE_CONSTANT
1.8897261246257702

LATTICE_VECTORS
4.050000000000 0.000000000000 0.000000000000
0.000000000000 4.050000000000 0.000000000000
0.000000000000 0.000000000000 4.050000000000

ATOMIC_POSITIONS
Direct
Al
0.0
4
0.000000000000 0.000000000000 0.000000000000 1 1 1
0.000000000000 0.500000000000 0.500000000000 1 1 1
0.500000000000 0.000000000000 0.500000000000 1 1 1
0.500000000000 0.500000000000 0.000000000000 1 1 1
