ATOMIC_SPECIES
Ni 58.693400 Ni_ONCV_PBE-1.0.upf
O 15.999400 O_ONCV_PBE-1.0.upf

NUMERICAL_ORBITAL
Ni_gga_8au_100Ry_2s2p1d.orb
O_gga_8au_100Ry_2s2p1d.orb

LATTICE_CONSTANT
1.889726

LATTICE_VECTORS
    4.17000000000     2.08500000000     2.08500000000
    2.08500000000     4.17000000000     2.08500000000
    2.08500000000     2.08500000000     4.17000000000

ATOMIC_POSITIONS
Direct

Ni
0.000000
2
    0.00000000000     0.00000000000     0.00000000000 0 0 1 mag   2.00000000 
    0.50000000000     0.50000000000     0.50000000000 1 1 1 mag  -2.00000000 

O
0.000000
2
    0.25000000000     0.25000000000     0.25000000000 0 0 0 mag   0.00000000 
    0.75000000000     0.75000000000     0.75000000000 1 0 1 mag   0.00000000 
