# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0SJ' 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 0.78900 2.62800 -1.17400 1.000 C1 C 1.70200 2.10900 -0.55200 1.000 C2 C 2.40600 2.85800 0.40100 1.000 C3 C 3.37100 2.24500 1.14600 1.000 C4 C 3.61100 0.88000 0.95000 1.000 C5 C 2.91800 0.18500 0.00900 1.000 N6 N 2.02200 0.81200 -0.78500 1.000 C7 C 1.40800 0.17800 -1.95200 1.000 C8 C 1.46400 -1.33700 -1.88300 1.000 C9 C 0.42700 -1.90300 -0.92200 1.000 C10 C 2.87300 -1.78900 -1.50000 1.000 C11 C 3.17500 -1.30100 -0.08800 1.000 C12 C 2.20000 -2.00800 0.86900 1.000 N13 N 0.82800 -1.64300 0.46600 1.000 C14 C -0.03500 -1.08600 1.33900 1.000 O15 O 0.28600 -0.94000 2.50200 1.000 C16 C -1.37200 -0.65300 0.88200 1.000 C17 C -2.17400 -1.52100 0.13800 1.000 C18 C -3.42000 -1.11200 -0.28500 1.000 C19 C -3.87800 0.15800 0.02700 1.000 Cl20 Cl -5.44600 0.66900 -0.51500 1.000 C21 C -3.08800 1.02300 0.76500 1.000 C22 C -1.84100 0.62300 1.19800 1.000 H23 H 2.18900 3.90600 0.54400 1.000 H24 H 3.94000 2.80300 1.87400 1.000 H25 H 4.35400 0.37600 1.55000 1.000 H26 H 0.36600 0.49000 -2.01700 1.000 H27 H 1.93000 0.51000 -2.85000 1.000 H28 H 1.24000 -1.73000 -2.87500 1.000 H29 H -0.53700 -1.43300 -1.11300 1.000 H30 H 0.34000 -2.97800 -1.07700 1.000 H31 H 2.93200 -2.87700 -1.53500 1.000 H32 H 3.59700 -1.36000 -2.19200 1.000 H33 H 4.20800 -1.52100 0.18000 1.000 H34 H 2.33500 -3.08800 0.80500 1.000 H35 H 2.37500 -1.67200 1.89100 1.000 H36 H -1.81800 -2.51100 -0.10600 1.000 H37 H -4.04100 -1.78200 -0.86100 1.000 H38 H -3.45000 2.01200 1.00400 1.000 H39 H -1.22600 1.29900 1.77400 1.000