ATOMIC_SPECIES
O 15.99903 O.LDA.UPF

NUMERICAL_ORBITAL
O_lda_8.0au_100Ry_2s2p1d.orb

LATTICE_CONSTANT
15

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

ATOMIC_POSITIONS
Cartesian

O #label
0 #magnetism
3 #number of atoms
0.507492 0.499989 0.512155112  m  1  1  1  v  0.0 0.0 0.0
0.533616248 0.500059 0.667595587  m  1  1  1  v  0.0 0.0 0.0
0.358202490 0.499964319 0.461568210  m  1  1  1  v  0.0 0.0 0.0
