# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9Y5' 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 2.28600 3.98000 0.38300 1.000 C1 C 1.36500 2.81000 0.15400 1.000 N2 N 0.05500 2.86200 0.11100 1.000 C3 C 1.76100 1.49300 -0.05400 1.000 N4 N 3.06500 0.95900 -0.11000 1.000 S5 S 3.23400 -0.63600 0.34600 1.000 O6 O 4.33100 -1.15500 -0.39400 1.000 O7 O 3.16900 -0.66200 1.76500 1.000 C8 C 1.78900 -1.46300 -0.24100 1.000 C9 C 1.81100 -2.81700 -0.48900 1.000 C10 C 0.66500 -3.45800 -0.93000 1.000 C11 C -0.50600 -2.74500 -1.11800 1.000 C12 C -0.53900 -1.38600 -0.87900 1.000 C13 C 0.61300 -0.73200 -0.44900 1.000 C14 C 0.61900 0.72500 -0.21900 1.000 N15 N -0.44600 1.57300 -0.12400 1.000 C16 C -1.79600 1.22000 -0.24300 1.000 C17 C -2.30800 0.16800 0.50500 1.000 C18 C -3.64100 -0.17700 0.38600 1.000 Cl19 Cl -4.28300 -1.49200 1.32100 1.000 C20 C -4.46400 0.52400 -0.47800 1.000 C21 C -3.95600 1.57100 -1.22400 1.000 C22 C -2.62600 1.92500 -1.10400 1.000 H23 H 2.54400 4.43300 -0.57400 1.000 H24 H 1.78700 4.71800 1.01100 1.000 H25 H 3.19400 3.63600 0.87800 1.000 H26 H 3.82300 1.49100 -0.39800 1.000 H27 H 2.72100 -3.37800 -0.34100 1.000 H28 H 0.68600 -4.51900 -1.12900 1.000 H29 H -1.39800 -3.25400 -1.45400 1.000 H30 H -1.45400 -0.83200 -1.02500 1.000 H31 H -1.66600 -0.37900 1.17900 1.000 H32 H -5.50500 0.25200 -0.57000 1.000 H33 H -4.60100 2.11600 -1.89700 1.000 H34 H -2.23000 2.74400 -1.68700 1.000