ATOMIC_SPECIES
H 1.008 H_ONCV_PBE-1.0.upf
C 12.010 C_ONCV_PBE-1.0.upf

LATTICE_CONSTANT
1.8897261254578281

LATTICE_VECTORS
9.500003790418825 0.0 0.0 
0.0 9.500003790418825 0.0 
0.0 0.0 9.500003790418825 

ATOMIC_POSITIONS
Cartesian    # Cartesian(Unit is LATTICE_CONSTANT)
H
0.0
4
5.113541511412 3.863321620159 3.422849404241 1 1 1
3.744792402058 4.563437069250 4.165241539141 1 1 1
5.246389147225 5.374789014111 4.205651315346 1 1 1
5.018535899770 3.954367806503 5.125120082345 1 1 1
C
0.0
1
4.780862617100 4.438958260529 4.229719202017 1 1 1

NUMERICAL_ORBITAL
H_gga_8au_60Ry_2s1p.orb
C_gga_8au_60Ry_2s2p1d.orb

NUMERICAL_DESCRIPTOR
jle.orb
