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
5.097444375976 3.891293394194 3.462261233691 1 1 1
3.796292512908 4.557084804487 4.168353214339 1 1 1
5.223523410907 5.328269903334 4.206766613435 1 1 1
5.007077103527 3.977914209143 5.081170168915 1 1 1
C
0.0
1
4.779784174238 4.440311459394 4.230030312730 1 1 1
