# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0CO' 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 -4.70700 0.08900 0.25200 1.000 C1 C -6.07200 0.12700 -0.40500 1.000 C2 C -6.25800 1.50300 -1.05300 1.000 C3 C -6.10800 2.59800 0.00400 1.000 C4 C -4.66700 2.62400 0.52300 1.000 C5 C -4.33500 1.25500 1.08200 1.000 C6 C -3.87400 -0.96000 0.09300 1.000 C7 C -2.56200 -0.95900 0.74500 1.000 C8 C -1.73900 -1.99500 0.58700 1.000 C9 C -0.38500 -2.05100 1.23000 1.000 C10 C 0.62500 -2.21700 0.05900 1.000 C11 C 0.38700 -3.57300 -0.56200 1.000 C12 C -0.99000 -3.53500 -1.24700 1.000 C13 C -2.10900 -3.21000 -0.25300 1.000 C14 C 0.12100 -0.76100 1.88000 1.000 C15 C 1.66400 -0.95100 1.86500 1.000 C16 C 1.96900 -1.95000 0.71900 1.000 C17 C -3.73800 1.10800 2.26400 1.000 O18 O -7.56000 1.58100 -1.63600 1.000 O19 O -3.77500 2.93500 -0.54900 1.000 C20 C 2.94000 -1.32600 -0.28600 1.000 C21 C 4.31200 -1.10500 0.38000 1.000 C22 C 4.55700 0.41800 0.24500 1.000 C23 C 3.60900 0.79800 -0.92100 1.000 O24 O 2.45300 -0.03900 -0.70100 1.000 C25 C 6.01500 0.70600 -0.12100 1.000 C26 C 6.25100 2.21700 -0.12400 1.000 C27 C 7.70900 2.50500 -0.49000 1.000 O28 O 5.38900 2.83200 -1.08300 1.000 C29 C 5.95400 2.78200 1.26600 1.000 C30 C 0.36500 -1.13000 -0.98700 1.000 C31 C 3.09300 -2.24400 -1.50000 1.000 H32 H -6.13400 -0.64900 -1.16800 1.000 H33 H -6.84600 -0.03300 0.34600 1.000 H34 H -5.50500 1.64300 -1.82900 1.000 H35 H -6.35200 3.56400 -0.43800 1.000 H36 H -6.78800 2.39700 0.83200 1.000 H37 H -4.57300 3.37400 1.30900 1.000 H38 H -4.17400 -1.80000 -0.51600 1.000 H39 H -2.26200 -0.11900 1.35300 1.000 H40 H -0.32100 -2.89100 1.92100 1.000 H41 H 1.16100 -3.78400 -1.29900 1.000 H42 H 0.39300 -4.34000 0.21300 1.000 H43 H -0.97500 -2.77700 -2.03000 1.000 H44 H -1.18900 -4.50700 -1.69800 1.000 H45 H -2.26900 -4.06500 0.40400 1.000 H46 H -3.02800 -3.00100 -0.80000 1.000 H47 H -0.16700 0.10800 1.28800 1.000 H48 H -0.24800 -0.67300 2.90200 1.000 H49 H 2.15700 0.00200 1.67200 1.000 H50 H 2.00000 -1.36100 2.81800 1.000 H51 H 2.38200 -2.87500 1.12200 1.000 H52 H -3.51300 0.12000 2.63800 1.000 H53 H -3.47700 1.97800 2.84900 1.000 H54 H -7.72500 0.91900 -2.32100 1.000 H55 H -2.84400 2.96800 -0.28900 1.000 H56 H 4.27700 -1.39400 1.43000 1.000 H57 H 5.08600 -1.66400 -0.14600 1.000 H58 H 4.27800 0.94000 1.16000 1.000 H59 H 3.33600 1.85200 -0.86600 1.000 H60 H 4.07100 0.57000 -1.88100 1.000 H61 H 6.67300 0.23600 0.61000 1.000 H62 H 6.22700 0.30300 -1.11200 1.000 H63 H 7.92100 2.10200 -1.48000 1.000 H64 H 7.87700 3.58200 -0.49200 1.000 H65 H 8.36700 2.03500 0.24200 1.000 H66 H 5.52300 2.52100 -1.98900 1.000 H67 H 6.61100 2.31300 1.99800 1.000 H68 H 6.12200 3.85900 1.26400 1.000 H69 H 4.91500 2.57800 1.52700 1.000 H70 H 0.47900 -0.14800 -0.52700 1.000 H71 H 1.08000 -1.23400 -1.80400 1.000 H72 H -0.64800 -1.23400 -1.37500 1.000 H73 H 2.10900 -2.47000 -1.91200 1.000 H74 H 3.69800 -1.74600 -2.25800 1.000 H75 H 3.58100 -3.17000 -1.19600 1.000