# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9KP' 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 -0.82900 -1.98100 -0.50300 1.000 C1 C -1.73000 -3.05200 -0.00100 1.000 O2 O -2.82300 -2.76600 0.44300 1.000 C3 C -2.50100 -0.26500 -0.04400 1.000 C4 C -3.04000 1.09000 -0.23500 1.000 C5 C -4.34400 1.40500 0.20500 1.000 C6 C -4.83900 2.69400 0.01700 1.000 C7 C -4.05700 3.65200 -0.59600 1.000 C8 C -2.77700 3.34400 -1.02800 1.000 C9 C -5.17500 0.37700 0.85900 1.000 N10 N 6.08700 0.94200 -1.43700 1.000 C11 C 5.62900 1.00600 -0.04300 1.000 C12 C 6.81900 0.95800 0.88000 1.000 O13 O 7.87500 0.52600 0.48200 1.000 C14 C 4.71100 -0.18300 0.24600 1.000 C15 C 3.44300 -0.06800 -0.60200 1.000 C16 C 2.52500 -1.25700 -0.31300 1.000 C17 C 1.31600 -1.20800 -1.24900 1.000 N18 N 0.37900 -2.27700 -0.89400 1.000 O19 O -1.33500 -4.33800 -0.03800 1.000 C20 C -1.30100 -0.59200 -0.56300 1.000 C21 C -2.26400 2.07600 -0.84800 1.000 O22 O -6.46000 0.64500 1.16600 1.000 O23 O -4.70300 -0.71100 1.12100 1.000 H24 H -3.06700 -0.99800 0.51200 1.000 H25 H -5.83600 2.94300 0.35000 1.000 H26 H -4.44700 4.64800 -0.74400 1.000 H27 H -2.17500 4.10300 -1.50700 1.000 H28 H 6.59800 0.09000 -1.61200 1.000 H29 H 5.31300 1.03800 -2.07700 1.000 H30 H 5.08100 1.93500 0.11700 1.000 O31 O 6.70600 1.39600 2.14400 1.000 H32 H 5.22900 -1.11000 0.00100 1.000 H33 H 4.44200 -0.18600 1.30300 1.000 H34 H 2.92500 0.86000 -0.35700 1.000 H35 H 3.71200 -0.06500 -1.65900 1.000 H36 H 3.07200 -2.18600 -0.47400 1.000 H37 H 2.18500 -1.21000 0.72200 1.000 H38 H 0.82000 -0.24200 -1.15200 1.000 H39 H 1.64800 -1.34400 -2.27900 1.000 H40 H -1.95500 -4.99800 0.29900 1.000 H41 H -0.68600 0.16700 -1.02400 1.000 H42 H -1.26500 1.84400 -1.18700 1.000 H43 H -6.96500 -0.06000 1.59300 1.000 H44 H 7.49700 1.34500 2.69800 1.000