# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C50' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N -6.07100 0.23700 -0.98200 1.000 C1 C -6.61500 0.15000 0.20300 1.000 N2 N -5.89900 -0.17700 1.29300 1.000 C3 C -4.57900 -0.17700 1.26300 1.000 N4 N -3.94900 0.19100 0.09900 1.000 C5 C -4.64800 -0.07000 -1.16800 1.000 N6 N -7.96500 0.40100 0.34000 1.000 N7 N -3.85600 -0.53500 2.36600 1.000 O8 O -2.67100 0.80100 0.11900 1.000 C9 C -1.58400 -0.12400 0.06000 1.000 C10 C -0.26000 0.64100 0.08800 1.000 C11 C 0.90400 -0.35000 0.02400 1.000 O12 O 2.14100 0.36500 0.05000 1.000 C13 C 3.28200 -0.37200 0.00100 1.000 C14 C 4.51800 0.25800 0.02200 1.000 C15 C 5.67700 -0.49600 -0.02900 1.000 C16 C 5.60300 -1.87600 -0.10100 1.000 C17 C 4.37200 -2.50400 -0.12200 1.000 C18 C 3.21200 -1.75600 -0.06600 1.000 Cl19 Cl 4.61100 1.98900 0.11200 1.000 Cl20 Cl 7.22500 0.29000 -0.00200 1.000 C21 C -4.06900 0.82000 -2.27000 1.000 C22 C -4.48500 -1.54100 -1.55400 1.000 H23 H -8.49500 0.63800 -0.43700 1.000 H24 H -8.38400 0.34000 1.21200 1.000 H25 H -4.31200 -0.79300 3.18200 1.000 H26 H -2.88700 -0.53100 2.33200 1.000 H27 H -1.63300 -0.79700 0.91600 1.000 H28 H -1.65000 -0.70300 -0.86100 1.000 H29 H -0.21100 1.31400 -0.76800 1.000 H30 H -0.19400 1.22000 1.00900 1.000 H31 H 0.85500 -1.02300 0.88100 1.000 H32 H 0.83900 -0.92900 -0.89700 1.000 H33 H 6.50900 -2.46300 -0.14100 1.000 H34 H 4.31700 -3.58100 -0.17900 1.000 H35 H 2.25000 -2.24800 -0.08300 1.000 H36 H -4.17800 1.86700 -1.98700 1.000 H37 H -3.01200 0.58900 -2.40600 1.000 H38 H -4.60300 0.63800 -3.20300 1.000 H39 H -5.02100 -1.73600 -2.48200 1.000 H40 H -3.42700 -1.76600 -1.69200 1.000 H41 H -4.88900 -2.17200 -0.76200 1.000