# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CIN' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy C0 C -0.44700 -0.00000 0.39200 1.000 C1 C -1.54100 0.00000 -0.47900 1.000 C2 C -1.33600 0.00000 -1.84000 1.000 C3 C -0.03500 -0.00000 -2.35100 1.000 C4 C 1.05700 -0.00100 -1.48100 1.000 C5 C 0.85400 0.00500 -0.12000 1.000 C6 C -0.66500 -0.00000 1.84800 1.000 C7 C 0.38900 -0.00000 2.68800 1.000 C8 C 0.17200 -0.00000 4.13600 1.000 C9 C 0.18300 -0.00000 -3.81200 1.000 O10 O -0.95900 -0.00000 4.58100 1.000 O11 O 1.22700 -0.00000 4.97600 1.000 O12 O -0.76600 -0.00000 -4.56900 1.000 O13 O 1.43700 -0.00000 -4.30500 1.000 H14 H -2.54600 0.00000 -0.08400 1.000 H15 H -2.18000 0.00000 -2.51300 1.000 H16 H 2.06200 -0.00100 -1.87700 1.000 H17 H 1.69900 0.00500 0.55200 1.000 H18 H -1.67000 0.00000 2.24400 1.000 H19 H 1.39400 -0.00000 2.29300 1.000 H20 H 1.08400 -0.00000 5.93300 1.000 H21 H 1.58000 -0.00000 -5.26200 1.000