# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0KM' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O -3.31200 0.59000 -2.05600 1.000 C1 C -2.86700 0.99300 -1.00300 1.000 C2 C -2.02800 0.21000 -0.01500 1.000 N3 N -1.76300 1.16300 1.07500 1.000 C4 C -2.38400 2.33800 0.72900 1.000 N5 N -3.01700 2.22700 -0.48400 1.000 N6 N -2.37000 3.41800 1.45500 1.000 C7 C -3.76300 3.31000 -1.13000 1.000 C8 C -2.79600 -0.97900 0.50100 1.000 C9 C -2.81300 -1.25700 1.85500 1.000 C10 C -3.51700 -2.34800 2.32800 1.000 C11 C -4.20400 -3.16300 1.44700 1.000 C12 C -4.18700 -2.88500 0.09300 1.000 C13 C -3.48800 -1.79000 -0.37900 1.000 C14 C -0.73700 -0.23100 -0.65400 1.000 C15 C -0.76100 -0.91800 -1.85500 1.000 C16 C 0.42100 -1.32100 -2.45000 1.000 C17 C 1.63000 -1.04100 -1.84900 1.000 C18 C 1.66000 -0.35000 -0.63900 1.000 C19 C 0.46700 0.05400 -0.04400 1.000 C20 C 5.37900 0.52900 1.23500 1.000 C21 C 4.15000 -0.44900 -0.58300 1.000 C22 C 2.95800 -0.04500 0.01300 1.000 C23 C 2.98800 0.65700 1.21600 1.000 C24 C 4.19600 0.93500 1.82300 1.000 C25 C 5.35900 -0.16100 0.03000 1.000 O26 O 6.52400 -0.55300 -0.54900 1.000 C27 C 7.73300 -0.22100 0.13800 1.000 H28 H -2.83100 4.21400 1.14800 1.000 H29 H -4.80500 3.27300 -0.81200 1.000 H30 H -3.33000 4.26900 -0.84600 1.000 H31 H -3.70900 3.19300 -2.21300 1.000 H32 H -2.27700 -0.62100 2.54300 1.000 H33 H -3.53000 -2.56500 3.38600 1.000 H34 H -4.75000 -4.01800 1.81600 1.000 H35 H -4.72300 -3.52200 -0.59500 1.000 H36 H -3.47400 -1.57400 -1.43700 1.000 H37 H -1.70600 -1.14000 -2.32900 1.000 H38 H 0.39600 -1.85700 -3.38800 1.000 H39 H 2.55200 -1.35700 -2.31400 1.000 H40 H 0.48500 0.59400 0.89100 1.000 H41 H 6.32200 0.75300 1.71100 1.000 H42 H 4.13300 -0.98500 -1.52000 1.000 H43 H 2.06600 0.97900 1.67600 1.000 H44 H 4.21800 1.47100 2.76100 1.000 H45 H 8.58700 -0.59100 -0.43000 1.000 H46 H 7.80700 0.86100 0.24200 1.000 H47 H 7.72700 -0.68200 1.12600 1.000 H48 H -1.24900 0.99400 1.88100 1.000