ATOMIC_SPECIES
H 1.008 H_ONCV_PBE-1.0.upf
O 15.9994 O_ONCV_PBE-1.0.upf

NUMERICAL_ORBITAL
H_gga_8au_60Ry_2s1p.orb
O_gga_7au_60Ry_2s2p1d.orb

NUMERICAL_DESCRIPTOR
jle.orb


LATTICE_CONSTANT
1

LATTICE_VECTORS
28 0 0
0 28 0
0 0  28

ATOMIC_POSITIONS
Cartesian

H
0
2
-12.046787058887078 18.76558614676448 8.395247471328744 1 1 1
-14.228868795885418 20.61549300274637 7.611989524516571 1 1 1
O
0
1
-13.486789117423204 19.684192208418636 8.958321352749174 1 1 1
