ATOMIC_SPECIES
C 12.0096 C.LDA.UPF
O 15.99903 O.LDA.UPF

NUMERICAL_ORBITAL
C_lda_8.0au_100Ry_2s2p1d.orb
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
Direct

C #label
0 #magnetism
1 #number of atoms
0.5 0.5 0.5 m 1 1 1 v 0 0 0

O #label
0 #magnetism
1 #number of atoms
0.5 0.5 0.645 m 1 1 1 v 0 0 0
