# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9J8' 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 -0.60400 4.96500 -2.24900 1.000 C1 C -0.74300 4.58900 -0.77200 1.000 N2 N -1.33600 3.25400 -0.66200 1.000 C3 C -1.46200 2.67000 0.54600 1.000 O4 O -1.16600 3.28300 1.55000 1.000 C5 C -1.97200 1.25600 0.65000 1.000 C6 C -3.49500 1.27200 0.79200 1.000 C7 C -4.11300 1.78700 -0.48200 1.000 C8 C -4.97700 1.05100 -1.13600 1.000 C9 C -1.35300 0.57900 1.87500 1.000 N10 N 0.10400 0.50600 1.71900 1.000 C11 C -1.87300 -0.83100 1.99700 1.000 N12 N -2.54700 -1.34400 2.98600 1.000 N13 N -2.78000 -2.58800 2.75100 1.000 C14 C -2.27500 -2.92500 1.59300 1.000 C15 C -2.31700 -4.29200 0.95900 1.000 N16 N -1.70700 -1.80700 1.07000 1.000 C17 C -1.10500 -1.65800 -0.18100 1.000 C18 C -1.62800 -2.37300 -1.25400 1.000 C19 C -1.09100 -2.23500 -2.51700 1.000 C20 C -0.02000 -1.37500 -2.72500 1.000 O21 O 0.49900 -1.22700 -3.97200 1.000 C22 C -0.10600 -1.98600 -5.02100 1.000 C23 C 0.51700 -0.67000 -1.66600 1.000 C24 C -0.00900 -0.81400 -0.37400 1.000 C25 C 0.65300 -0.09900 0.72300 1.000 C26 C 2.13300 -0.06800 0.68000 1.000 C27 C 2.83000 0.96400 1.30600 1.000 C28 C 4.20900 0.98800 1.26300 1.000 C29 C 4.90000 -0.01200 0.59900 1.000 Cl30 Cl 6.63500 0.02800 0.54100 1.000 C31 C 4.21300 -1.03900 -0.02500 1.000 C32 C 2.83400 -1.07600 0.01700 1.000 H33 H -0.16200 5.95800 -2.33100 1.000 H34 H 0.03800 4.24000 -2.75000 1.000 H35 H -1.58800 4.96500 -2.71800 1.000 H36 H 0.24100 4.58900 -0.30300 1.000 H37 H -1.38400 5.31400 -0.27100 1.000 H38 H -1.63800 2.79000 -1.45900 1.000 H39 H -1.69600 0.70300 -0.24800 1.000 H40 H -3.85300 0.26100 0.98600 1.000 H41 H -3.77600 1.92200 1.62000 1.000 H42 H -3.84300 2.76400 -0.85700 1.000 H43 H -5.24700 0.07500 -0.76200 1.000 H44 H -5.42000 1.42000 -2.04900 1.000 H45 H -1.60100 1.14400 2.77300 1.000 H46 H -3.21600 -4.38200 0.35000 1.000 H47 H -1.43700 -4.42700 0.33100 1.000 H48 H -2.32700 -5.05400 1.73900 1.000 H49 H -2.46100 -3.04100 -1.09600 1.000 H50 H -1.50300 -2.79500 -3.34300 1.000 H51 H -0.02400 -3.04900 -4.79400 1.000 H52 H -1.15800 -1.71400 -5.10700 1.000 H53 H 0.40200 -1.77500 -5.96200 1.000 H54 H 1.34900 -0.00200 -1.83500 1.000 H55 H 2.29200 1.74500 1.82400 1.000 H56 H 4.75000 1.78700 1.74800 1.000 H57 H 4.75700 -1.81600 -0.54200 1.000 H58 H 2.29900 -1.87800 -0.47000 1.000