# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J60' 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 2.78300 -14.11000 -9.40900 1.000 C1 C 2.46000 -12.87000 -8.64700 1.000 N2 N 1.14300 -12.97300 -8.00000 1.000 C3 C 0.10800 -13.17700 -9.02500 1.000 C4 C -1.24500 -13.28700 -8.40800 1.000 C5 C 0.86300 -11.81400 -7.19600 1.000 C6 C 1.90400 -11.61000 -6.10800 1.000 N7 N 1.61400 -10.45800 -5.28500 1.000 C8 C 0.83400 -10.49700 -4.11400 1.000 O9 O 0.33100 -11.57000 -3.70700 1.000 C10 C 0.61600 -9.26100 -3.41600 1.000 C11 C 0.55200 -7.95300 -3.95800 1.000 C12 C 0.70000 -7.58800 -5.38300 1.000 C13 C 0.42800 -9.15200 -2.05600 1.000 C14 C 0.39500 -10.17600 -0.99300 1.000 N15 N 0.25300 -7.82500 -1.76100 1.000 C16 C 0.33000 -7.11500 -2.91500 1.000 C17 C 0.17000 -5.69400 -2.81200 1.000 C18 C 1.17100 -4.82700 -2.64900 1.000 C19 C 1.10600 -3.37400 -2.53500 1.000 C20 C 0.06600 -2.46300 -2.55400 1.000 C21 C 0.38100 -1.10800 -2.41200 1.000 Cl22 Cl -0.88200 0.06500 -2.43000 1.000 C23 C 1.71500 -0.68600 -2.25600 1.000 C24 C 2.76000 -1.61200 -2.23800 1.000 C25 C 2.42700 -2.94500 -2.37900 1.000 N26 N 3.30300 -4.03600 -2.39000 1.000 C27 C 2.61100 -5.24100 -2.55300 1.000 O28 O 3.04900 -6.37500 -2.60600 1.000 H29 H 2.82500 -14.97800 -8.74300 1.000 H30 H 2.04000 -14.29100 -10.19200 1.000 H31 H 3.76300 -14.00500 -9.89000 1.000 H32 H 2.43700 -12.00400 -9.31500 1.000 H33 H 3.20300 -12.69100 -7.86400 1.000 H34 H 0.14700 -12.32800 -9.71400 1.000 H35 H 0.35800 -14.08900 -9.57400 1.000 H36 H -0.12600 -11.96300 -6.75100 1.000 H37 H 0.81400 -10.95100 -7.86800 1.000 H38 H -1.29800 -14.14500 -7.73000 1.000 H39 H -1.49800 -12.37500 -7.85600 1.000 H40 H -2.00000 -13.42800 -9.19100 1.000 H41 H 2.90200 -11.46600 -6.53300 1.000 H42 H 1.92900 -12.48000 -5.44500 1.000 H43 H 1.95000 -9.55900 -5.61500 1.000 H44 H -0.00800 -8.15200 -6.01100 1.000 H45 H 0.51900 -6.51400 -5.55300 1.000 H46 H 1.71700 -7.79100 -5.75700 1.000 H47 H 1.01300 -9.87500 -0.13200 1.000 H48 H -0.62900 -10.35600 -0.62400 1.000 H49 H 0.76700 -11.15200 -1.34800 1.000 H50 H 0.09400 -7.45400 -0.83400 1.000 H51 H -0.83900 -5.28900 -2.90000 1.000 H52 H -0.96100 -2.79100 -2.67400 1.000 H53 H 1.94800 0.37000 -2.14700 1.000 H54 H 3.78800 -1.28900 -2.11700 1.000 H55 H 4.30800 -3.94800 -2.29200 1.000