ATOMIC_SPECIES
H 1.00794 H.LDA.UPF 1/r

LATTICE_CONSTANT
3

LATTICE_VECTORS
1 0 0 #latvec1
0 1 0 #latvec2
0 0 1 #latvec3

ATOMIC_POSITIONS
Cartesian

H #label
0 #magnetism
2 #number of atoms
0.502095122795  0.474071446432  0.509122850526
0.497904877205  0.525928553568  0.592277149473 
