# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C5C' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N 2.26700 -0.62200 -2.28600 1.000 C1 C 0.88000 -0.43000 -1.83900 1.000 C2 C -0.02600 -0.34400 -3.04000 1.000 O3 O 0.39100 0.10200 -4.08200 1.000 C4 C 0.77900 0.86300 -1.02900 1.000 S5 S -0.93800 1.11600 -0.50600 1.000 S6 S -1.16200 -0.47500 0.76400 1.000 C7 C -0.63200 0.28800 2.32200 1.000 C8 C -0.71300 -0.73600 3.46600 1.000 C9 C 0.71700 -0.89000 4.02300 1.000 C10 C 1.42000 0.43300 3.63100 1.000 C11 C 0.84400 0.72200 2.22300 1.000 O12 O -1.29800 -0.76300 -2.95100 1.000 H13 H 2.83600 -0.66500 -1.45400 1.000 H14 H 2.53200 0.21900 -2.77500 1.000 H15 H 0.58000 -1.27300 -1.21700 1.000 H16 H 1.42000 0.79300 -0.15000 1.000 H17 H 1.09900 1.70300 -1.64600 1.000 H18 H -1.26100 1.15000 2.54800 1.000 H19 H -1.38000 -0.37200 4.24800 1.000 H20 H -1.07000 -1.69300 3.08600 1.000 H21 H 0.69500 -1.00400 5.10600 1.000 H22 H 1.21700 -1.74000 3.55900 1.000 H23 H 1.15900 1.23000 4.32700 1.000 H24 H 2.50100 0.29700 3.58500 1.000 H25 H 1.36500 0.13300 1.46800 1.000 H26 H 0.91400 1.78600 1.99300 1.000 H27 H -1.88000 -0.70800 -3.72100 1.000