# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0PC' 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 1.80100 0.09500 -0.42300 1.000 O1 O 1.79500 -0.83100 -1.20900 1.000 O2 O 2.96400 0.67800 -0.07700 1.000 C3 C 4.17200 0.14800 -0.68300 1.000 C4 C 5.36600 0.91900 -0.18200 1.000 C5 C 6.03000 0.50200 0.95600 1.000 C6 C 7.12500 1.20900 1.41700 1.000 C7 C 7.55600 2.33400 0.73900 1.000 C8 C 6.89100 2.75200 -0.39900 1.000 C9 C 5.79900 2.04200 -0.86200 1.000 N10 N 0.64100 0.54200 0.10000 1.000 C11 C -0.62500 -0.08900 -0.28100 1.000 C12 C -1.75100 0.89600 -0.09700 1.000 O13 O -1.51900 2.01400 0.31200 1.000 C14 C -0.87000 -1.31400 0.60200 1.000 C15 C 0.19000 -2.35100 0.32700 1.000 C16 C 1.36400 -2.34800 1.05700 1.000 C17 C -0.01600 -3.30700 -0.64900 1.000 C18 C 2.33600 -3.29800 0.80500 1.000 C19 C 0.95600 -4.25700 -0.90100 1.000 C20 C 2.13300 -4.25200 -0.17500 1.000 N21 N -3.01700 0.53400 -0.38700 1.000 C22 C -4.11100 1.49000 -0.20800 1.000 C23 C -5.40200 0.74300 0.00700 1.000 O24 O -5.46800 -0.43500 -0.25300 1.000 C25 C -4.23200 2.36600 -1.45700 1.000 C26 C -6.61000 1.46400 0.54700 1.000 Cl27 Cl -7.98600 0.30800 0.69100 1.000 H28 H 4.28100 -0.90300 -0.41800 1.000 H29 H 4.10700 0.24400 -1.76700 1.000 H30 H 5.69400 -0.37800 1.48600 1.000 H31 H 7.64400 0.88300 2.30600 1.000 H32 H 8.41000 2.88800 1.09900 1.000 H33 H 7.22700 3.63100 -0.92800 1.000 H34 H 5.28300 2.36600 -1.75300 1.000 H35 H 0.64600 1.28100 0.72800 1.000 H36 H -0.57800 -0.39600 -1.32500 1.000 H37 H -0.82800 -1.02100 1.65100 1.000 H38 H -1.85200 -1.73100 0.38000 1.000 H39 H 1.52200 -1.60300 1.82200 1.000 H40 H -0.93500 -3.31200 -1.21600 1.000 H41 H 3.25300 -3.29600 1.37400 1.000 H42 H 0.79600 -5.00500 -1.66400 1.000 H43 H 2.89200 -4.99400 -0.37200 1.000 H44 H -3.20300 -0.36100 -0.71400 1.000 H45 H -3.90700 2.11900 0.65800 1.000 H46 H -5.04700 3.07800 -1.32400 1.000 H47 H -3.29900 2.90700 -1.61200 1.000 H48 H -4.43700 1.73800 -2.32300 1.000 H49 H -6.37800 1.87700 1.52900 1.000 H50 H -6.88400 2.27200 -0.13100 1.000