# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C1V' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O -1.12000 1.53500 0.10300 1.000 C1 C -2.31200 0.89900 0.05200 1.000 C2 C -2.36500 -0.52300 0.02000 1.000 C3 C -3.50100 1.63100 0.03500 1.000 C4 C -3.47100 3.06200 0.07100 1.000 N5 N -3.44800 4.19700 0.10000 1.000 C6 C -4.73600 0.94100 -0.01900 1.000 O7 O -5.78100 1.56800 -0.03500 1.000 N8 N -4.75900 -0.40000 -0.05300 1.000 C9 C -3.59900 -1.14600 -0.03200 1.000 S10 S -3.38800 -2.89400 -0.06200 1.000 C11 C -1.64200 -2.75700 -0.00300 1.000 C12 C -1.26200 -1.48200 0.03500 1.000 C13 C 0.15900 -1.06900 0.08800 1.000 C14 C 1.01700 -1.63900 1.03000 1.000 C15 C 2.33900 -1.25500 1.07900 1.000 C16 C 0.64300 -0.11400 -0.80800 1.000 C17 C 1.96400 0.26900 -0.75800 1.000 C18 C 2.82000 -0.29600 0.18700 1.000 C19 C 4.24300 0.11800 0.24100 1.000 C20 C 4.81900 0.49000 1.45400 1.000 C21 C 6.14300 0.87300 1.49800 1.000 C22 C 6.90300 0.89100 0.34100 1.000 C23 C 6.34200 0.52400 -0.86700 1.000 C24 C 5.01400 0.13100 -0.92600 1.000 O25 O 4.46300 -0.23600 -2.11200 1.000 H26 H -1.19000 2.49900 0.12100 1.000 H27 H -5.61400 -0.85600 -0.09000 1.000 H28 H -0.96200 -3.59600 0.00100 1.000 H29 H 0.64500 -2.38100 1.72000 1.000 H30 H -0.02000 0.32300 -1.54000 1.000 H31 H 3.00300 -1.69600 1.80800 1.000 H32 H 2.33800 1.00800 -1.45200 1.000 H33 H 4.22900 0.47800 2.35800 1.000 H34 H 6.58900 1.16100 2.43800 1.000 H35 H 7.93900 1.19300 0.38300 1.000 H36 H 6.94000 0.53900 -1.76700 1.000 H37 H 4.06600 0.49600 -2.60400 1.000