# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9OS' 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 4.41600 0.24600 0.18200 1.000 C1 C 1.13500 -0.83300 1.70600 1.000 N2 N 7.12200 2.46200 -0.55100 1.000 C3 C 6.33800 1.31800 -0.53400 1.000 N4 N 5.20400 1.32600 0.13800 1.000 C5 C 6.76900 0.18100 -1.23200 1.000 C6 C 6.00800 -0.94900 -1.22400 1.000 C7 C 4.79700 -0.93400 -0.50300 1.000 C8 C 3.96600 -2.06400 -0.45200 1.000 C9 C 2.80300 -2.01300 0.25500 1.000 C10 C 2.42600 -0.85400 0.92900 1.000 C11 C 3.21100 0.25900 0.90400 1.000 N12 N 0.04500 -0.37800 0.83300 1.000 C13 C -1.23200 -0.34600 1.55800 1.000 C14 C -2.34000 0.13200 0.61800 1.000 C15 C -3.67000 0.16600 1.37300 1.000 C16 C -4.76200 0.63600 0.44700 1.000 C17 C -5.12700 1.96600 0.41500 1.000 C18 C -5.41300 -0.26500 -0.39200 1.000 O19 O -5.07900 -1.58100 -0.39300 1.000 C20 C -5.79900 -2.43200 -1.28700 1.000 C21 C -6.41500 0.21800 -1.22900 1.000 C22 C -6.72600 1.56200 -1.19800 1.000 N23 N -6.08200 2.38600 -0.39300 1.000 H24 H 0.91400 -1.83700 2.07000 1.000 H25 H 1.23100 -0.15300 2.55200 1.000 H26 H 7.95900 2.46800 -1.04200 1.000 H27 H 6.83500 3.25500 -0.07200 1.000 H28 H 7.70200 0.20100 -1.77500 1.000 H29 H 6.32500 -1.83400 -1.75600 1.000 H30 H 4.24700 -2.96800 -0.97000 1.000 H31 H 2.16400 -2.88300 0.29400 1.000 H32 H 2.90900 1.14700 1.43900 1.000 H33 H -0.02200 -0.95500 0.00800 1.000 H34 H -1.46900 -1.34600 1.92100 1.000 H35 H -1.15200 0.33800 2.40300 1.000 H36 H -2.10300 1.13200 0.25500 1.000 H37 H -2.42000 -0.55200 -0.22700 1.000 H38 H -3.90800 -0.83400 1.73700 1.000 H39 H -3.59100 0.85000 2.21800 1.000 H40 H -4.62500 2.67200 1.06000 1.000 H41 H -5.43500 -3.45400 -1.18800 1.000 H42 H -6.86100 -2.40000 -1.04300 1.000 H43 H -5.65100 -2.09100 -2.31200 1.000 H44 H -6.94200 -0.45000 -1.89500 1.000 H45 H -7.50200 1.94500 -1.84400 1.000