# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C0D' 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 6.26200 1.51100 -0.18700 1.000 C1 C 4.87600 0.99500 0.20600 1.000 C2 C 4.89900 0.53100 1.66400 1.000 C3 C 3.84900 2.11800 0.04500 1.000 C4 C 4.49400 -0.17900 -0.69700 1.000 O5 O 5.51700 -1.17600 -0.64200 1.000 C6 C 3.19000 -0.77100 -0.22600 1.000 O7 O 3.18000 -1.84500 0.33700 1.000 N8 N 2.03500 -0.10700 -0.43100 1.000 C9 C 0.75900 -0.72900 -0.07100 1.000 C10 C -0.38700 0.22900 -0.40300 1.000 C11 C -1.70000 -0.41100 -0.03300 1.000 O12 O -1.71800 -1.52300 0.44900 1.000 N13 N -2.85500 0.25400 -0.23800 1.000 C14 C -4.13100 -0.36800 0.12200 1.000 C15 C -5.27700 0.59000 -0.21100 1.000 C16 C -6.61000 -0.06000 0.16600 1.000 C17 C -7.75600 0.89800 -0.16700 1.000 C18 C -9.09000 0.24800 0.20900 1.000 H19 H 6.24500 1.84100 -1.22500 1.000 H20 H 6.53400 2.34700 0.45700 1.000 H21 H 6.99300 0.71100 -0.07200 1.000 H22 H 5.63000 -0.26900 1.77900 1.000 H23 H 5.17200 1.36700 2.30700 1.000 H24 H 3.91200 0.16400 1.94400 1.000 H25 H 2.88800 1.79100 0.44200 1.000 H26 H 4.18700 3.00000 0.58900 1.000 H27 H 3.74200 2.36300 -1.01200 1.000 H28 H 4.38400 0.17200 -1.72300 1.000 H29 H 5.66900 -1.53400 0.24300 1.000 H30 H 2.05000 0.78300 -0.81700 1.000 H31 H 0.63400 -1.65400 -0.63400 1.000 H32 H 0.75000 -0.94900 0.99600 1.000 H33 H -0.26200 1.15400 0.15900 1.000 H34 H -0.37800 0.44900 -1.47100 1.000 H35 H -2.84100 1.14300 -0.62400 1.000 H36 H -4.25600 -1.29300 -0.44100 1.000 H37 H -4.14000 -0.58900 1.18900 1.000 H38 H -5.15200 1.51500 0.35200 1.000 H39 H -5.26900 0.81000 -1.27800 1.000 H40 H -6.73500 -0.98500 -0.39700 1.000 H41 H -6.61900 -0.28000 1.23300 1.000 H42 H -7.63100 1.82300 0.39600 1.000 H43 H -7.74800 1.11800 -1.23500 1.000 H44 H -9.90600 0.93100 -0.02800 1.000 H45 H -9.21500 -0.67700 -0.35400 1.000 H46 H -9.09800 0.02800 1.27600 1.000