<filename>examples/c2.py
StructureData = DataFactory('structure')
cell=[[   15.8753100000,    0.0000000000,    0.0000000000],
    [0.0000000000 , 15.8753100000 , 0.0000000000],
    [0.0000000000  , 0.0000000000  , 2.4696584760]]
s = StructureData(cell=cell)
s.append_atom(position=(0.0000000000, 0.0000000000, -0.5857830640), symbols='C')
s.append_atom(position=(0.6483409550, 0.0000000000, 0.5857863990), symbols='C')
s.append_atom(position=(-1.0769905460, 0.0000000000, -0.5902956470), symbols='H')
s.append_atom(position=(1.7253315010, 0.0000000000, 0.5902989820), symbols='H')
print s.store()
