# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '92M' 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 -3.21200 -0.25100 -0.14800 1.000 C1 C -2.81000 -1.59000 -0.07200 1.000 C2 C -1.46000 -1.88100 -0.03400 1.000 N3 N -0.58900 -0.88100 -0.08200 1.000 N4 N -2.28300 0.69600 -0.20100 1.000 C5 C 5.53400 -0.95200 1.33000 1.000 C6 C 7.02600 -1.16300 1.59700 1.000 C7 C 7.74400 -1.43100 0.27100 1.000 O8 O 9.14600 -1.57200 0.50800 1.000 C9 C 7.50200 -0.25500 -0.67800 1.000 C10 C 5.99600 -0.07000 -0.88000 1.000 N11 N 5.35500 0.18400 0.41700 1.000 C12 C 3.99800 0.48800 0.25500 1.000 C13 C 3.61600 1.53500 -0.57300 1.000 C14 C 2.27300 1.83500 -0.73300 1.000 O15 O 1.89700 2.86000 -1.54400 1.000 C16 C 2.93900 3.58500 -2.20000 1.000 C17 C 3.03500 -0.26100 0.91800 1.000 C18 C 1.69500 0.03600 0.75900 1.000 C19 C 1.31000 1.08500 -0.06300 1.000 N20 N -0.05100 1.38700 -0.22300 1.000 C21 C -0.99700 0.37600 -0.16700 1.000 N22 N -3.77800 -2.60600 -0.05500 1.000 C23 C -3.72400 -3.68000 0.94000 1.000 C24 C -4.76100 -2.56700 -0.98100 1.000 O25 O -5.65300 -3.39000 -0.96200 1.000 C26 C -4.74000 -1.49400 -2.03600 1.000 C27 C -5.18700 -0.15800 -1.45000 1.000 N28 N -4.55800 0.06700 -0.14600 1.000 C29 C -4.77200 1.44700 0.31100 1.000 C30 C -4.14300 1.65800 1.70400 1.000 C31 C -5.09900 2.57900 2.48300 1.000 C32 C -6.27400 2.89600 1.53500 1.000 C33 C -6.28100 1.71700 0.53000 1.000 H34 H -1.12000 -2.90400 0.03500 1.000 H35 H 5.11600 -1.85100 0.87700 1.000 H36 H 5.02200 -0.74700 2.27000 1.000 H37 H 7.44200 -0.26900 2.06200 1.000 H38 H 7.16000 -2.01600 2.26200 1.000 H39 H 7.35600 -2.34700 -0.17500 1.000 H40 H 9.66500 -1.74400 -0.29000 1.000 H41 H 7.92500 0.65300 -0.24900 1.000 H42 H 7.97500 -0.45900 -1.63900 1.000 H43 H 5.81900 0.77500 -1.54400 1.000 H44 H 5.57500 -0.97400 -1.32200 1.000 H45 H 4.36500 2.11500 -1.09200 1.000 H46 H 2.50300 4.37300 -2.81400 1.000 H47 H 3.59800 4.02900 -1.45400 1.000 H48 H 3.51100 2.90600 -2.83200 1.000 H49 H 3.33400 -1.07800 1.55800 1.000 H50 H 0.94800 -0.54800 1.27500 1.000 H51 H -0.33000 2.30400 -0.37400 1.000 H52 H -4.28900 -3.38400 1.82400 1.000 H53 H -4.15600 -4.58700 0.51900 1.000 H54 H -2.68700 -3.86600 1.21800 1.000 H55 H -3.72800 -1.39400 -2.42800 1.000 H56 H -5.41200 -1.77400 -2.84800 1.000 H57 H -4.90400 0.64600 -2.13000 1.000 H58 H -6.27100 -0.16200 -1.33100 1.000 H59 H -4.35500 2.15400 -0.40600 1.000 H60 H -4.04500 0.70200 2.21900 1.000 H61 H -3.16600 2.13100 1.60600 1.000 H62 H -5.46500 2.07000 3.37400 1.000 H63 H -4.58600 3.50000 2.76200 1.000 H64 H -7.21300 2.93000 2.08900 1.000 H65 H -6.10300 3.83900 1.01600 1.000 H66 H -6.76100 2.00900 -0.40400 1.000 H67 H -6.77100 0.84500 0.96200 1.000