# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C05' 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 -3.86200 1.87000 0.30200 1.000 S1 S -0.90300 -0.63100 -0.29500 1.000 O2 O 6.26100 0.25600 -0.55200 1.000 C3 C -2.05100 0.68100 -0.03800 1.000 O4 O 1.63200 -1.75100 -0.97700 1.000 C5 C -4.17100 -0.68100 0.16200 1.000 N6 N -2.83900 2.65000 0.21500 1.000 C7 C -4.88100 -0.83100 1.51900 1.000 N8 N -1.77100 1.96500 0.01500 1.000 C9 C -6.39500 -0.86200 1.22200 1.000 N10 N -3.38800 0.55700 0.14000 1.000 C11 C -6.48400 -1.33600 -0.25000 1.000 N12 N 3.02900 -0.22700 -0.17100 1.000 C13 C -5.27800 -0.62500 -0.91100 1.000 C14 C 0.63100 0.31800 -0.44200 1.000 C15 C 1.79900 -0.62800 -0.55000 1.000 C16 C 0.56900 1.19700 -1.69300 1.000 C17 C 4.16400 -1.14600 -0.27600 1.000 C18 C 5.41400 -0.45800 0.20700 1.000 C19 C 5.87200 -0.45500 1.47200 1.000 C20 C 7.06400 0.30500 1.47500 1.000 C21 C 7.26400 0.72100 0.21200 1.000 H22 H -3.52100 -1.53700 -0.01600 1.000 H23 H -4.57600 -1.76100 1.99900 1.000 H24 H -4.64400 0.01700 2.16100 1.000 H25 H -6.89800 -1.56900 1.88200 1.000 H26 H -6.82600 0.13300 1.33200 1.000 H27 H -6.37800 -2.41900 -0.31400 1.000 H28 H -7.42200 -1.01400 -0.70300 1.000 H29 H 3.16200 0.67100 0.17000 1.000 H30 H -5.52800 0.40900 -1.14900 1.000 H31 H -4.96600 -1.15900 -1.80900 1.000 H32 H 0.75400 0.94900 0.43900 1.000 H33 H 0.44600 0.56700 -2.57400 1.000 H34 H -0.27500 1.88100 -1.61500 1.000 H35 H 1.49300 1.76800 -1.78200 1.000 H36 H 3.97500 -2.02800 0.33600 1.000 H37 H 4.29300 -1.44700 -1.31600 1.000 H38 H 5.41600 -0.94000 2.32300 1.000 H39 H 7.69300 0.51200 2.32800 1.000 H40 H 8.09000 1.32700 -0.13100 1.000