# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '07J' 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 2.73200 0.27700 -0.08200 1.000 C1 C 3.07600 -0.73500 -0.66100 1.000 N2 N 4.38400 -1.04900 -0.75000 1.000 C3 C 5.35000 -0.18000 -0.22600 1.000 C4 C 6.42600 -0.68800 0.48900 1.000 Cl5 Cl 6.57600 -2.40000 0.73400 1.000 C6 C 7.38200 0.17300 1.00700 1.000 O7 O 8.43700 -0.32400 1.70600 1.000 C8 C 9.38300 0.62100 2.21100 1.000 C9 C 7.26300 1.54100 0.81100 1.000 C10 C 6.18800 2.04900 0.09700 1.000 O11 O 6.07200 3.39000 -0.09400 1.000 C12 C 7.09400 4.21600 0.46800 1.000 C13 C 5.23400 1.18900 -0.42700 1.000 Cl14 Cl 3.88900 1.82500 -1.32100 1.000 N15 N 2.15000 -1.54600 -1.21100 1.000 C16 C 2.55500 -2.81700 -1.81500 1.000 C17 C 0.80900 -1.17500 -1.20300 1.000 C18 C -0.04000 -1.62100 -0.19700 1.000 C19 C -1.37300 -1.22200 -0.23400 1.000 N20 N -1.78400 -0.43200 -1.22500 1.000 C21 C -0.94700 -0.03100 -2.16000 1.000 N22 N 0.32200 -0.38300 -2.15600 1.000 N23 N -2.26100 -1.64000 0.74600 1.000 C24 C -3.62300 -1.33500 0.63300 1.000 C25 C -4.21900 -1.27000 -0.61900 1.000 C26 C -5.56200 -0.97000 -0.73100 1.000 C27 C -6.31700 -0.73400 0.41000 1.000 C28 C -5.72200 -0.79900 1.66300 1.000 C29 C -4.38000 -1.10400 1.77500 1.000 N30 N -7.67900 -0.42900 0.29800 1.000 C31 C -8.28200 -0.21700 1.62100 1.000 C32 C -9.78300 0.03400 1.45900 1.000 N33 N -9.99100 1.20500 0.59500 1.000 C34 C -11.42000 1.52500 0.47700 1.000 C35 C -11.58400 2.87900 -0.21500 1.000 C36 C -9.38800 0.99300 -0.72800 1.000 C37 C -7.88700 0.74100 -0.56600 1.000 H38 H 4.65600 -1.87700 -1.17600 1.000 H39 H 8.88100 1.31100 2.88900 1.000 H40 H 10.17200 0.09300 2.74800 1.000 H41 H 9.81800 1.17800 1.38100 1.000 H42 H 8.00700 2.21100 1.21500 1.000 H43 H 6.88100 5.26100 0.24300 1.000 H44 H 7.12100 4.07600 1.54800 1.000 H45 H 8.05900 3.94200 0.04100 1.000 H46 H 2.53100 -3.60200 -1.06000 1.000 H47 H 1.87000 -3.06900 -2.62500 1.000 H48 H 3.56600 -2.72500 -2.21100 1.000 H49 H 0.32500 -2.26100 0.59300 1.000 H50 H -1.31100 0.60900 -2.95000 1.000 H51 H -1.93800 -2.14300 1.51000 1.000 H52 H -3.63100 -1.45400 -1.50700 1.000 H53 H -6.02500 -0.91900 -1.70500 1.000 H54 H -6.30900 -0.61500 2.55100 1.000 H55 H -3.91800 -1.15900 2.74900 1.000 H56 H -8.12600 -1.10200 2.23800 1.000 H57 H -7.81800 0.64600 2.09800 1.000 H58 H -10.25200 -0.84000 1.00700 1.000 H59 H -10.22800 0.22000 2.43700 1.000 H60 H -11.91700 0.75300 -0.11100 1.000 H61 H -11.86600 1.56800 1.47000 1.000 H62 H -12.64400 3.11600 -0.30300 1.000 H63 H -11.08600 3.65000 0.37300 1.000 H64 H -11.13800 2.83600 -1.20900 1.000 H65 H -9.85200 0.13000 -1.20500 1.000 H66 H -9.54400 1.87800 -1.34500 1.000 H67 H -7.41800 1.61500 -0.11400 1.000 H68 H -7.44200 0.55500 -1.54400 1.000