# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J7J' 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 -5.52100 0.37300 -0.41300 1.000 C1 C -5.16500 -0.90000 0.01900 1.000 C2 C -7.50000 -1.34600 0.34800 1.000 C3 C 1.55100 1.17900 0.31000 1.000 C4 C 0.79000 0.02600 0.16500 1.000 C5 C -0.55200 0.22400 0.21500 1.000 C6 C 2.98200 1.13100 0.27300 1.000 C7 C 4.15500 1.09200 0.24200 1.000 C8 C 5.58600 1.04400 0.20500 1.000 C9 C 6.24300 -0.17600 0.02500 1.000 C10 C 7.62100 -0.21400 -0.01000 1.000 C11 C 8.35300 0.95200 0.13200 1.000 C12 C 7.70900 2.16400 0.31000 1.000 C13 C 6.33100 2.21800 0.34200 1.000 C14 C 8.33200 -1.52900 -0.20300 1.000 N15 N -7.79300 -0.12900 -0.07300 1.000 C16 C -6.85700 0.72500 -0.44300 1.000 C17 C -6.18500 -1.77700 0.40800 1.000 Cl18 Cl -7.31200 2.31500 -0.97400 1.000 N19 N -3.82500 -1.29500 0.06300 1.000 C20 C -2.85300 -0.36800 0.17400 1.000 O21 O -3.14400 0.80100 0.34000 1.000 N22 N 0.91500 2.31200 0.47700 1.000 S23 S -0.74600 1.96800 0.45900 1.000 N24 N -1.55900 -0.73600 0.10000 1.000 Br25 Br 1.56100 -1.68300 -0.08500 1.000 O26 O 8.52800 -1.76400 -1.59900 1.000 N27 N -5.88000 -3.06900 0.85500 1.000 H28 H -4.76200 1.07900 -0.71700 1.000 H29 H -8.29500 -2.01500 0.64200 1.000 H30 H 5.67300 -1.08700 -0.08500 1.000 H31 H 9.43200 0.91600 0.10400 1.000 H32 H 8.28600 3.07000 0.41600 1.000 H33 H 5.83000 3.16500 0.48100 1.000 H34 H 9.29900 -1.49600 0.29800 1.000 H35 H 7.73000 -2.33300 0.22000 1.000 H36 H -3.59400 -2.23600 0.01300 1.000 H37 H -1.32700 -1.66800 -0.03200 1.000 H38 H 8.98100 -2.59400 -1.79900 1.000 H39 H -6.59200 -3.66900 1.12500 1.000 H40 H -4.95700 -3.36300 0.89300 1.000