# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0OA' 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 -6.48600 -3.42700 -0.23500 1.000 P1 P -6.19400 -2.02200 0.49400 1.000 O2 O -6.27300 -2.20200 1.96100 1.000 O3 O -4.72100 -1.50700 0.09600 1.000 C4 C -3.52800 -2.19900 0.46800 1.000 C5 C -2.31100 -1.44200 -0.06900 1.000 O6 O -2.33000 -1.46200 -1.49700 1.000 C7 C -1.72500 -0.31700 -2.10300 1.000 C8 C -1.03100 -2.11200 0.43400 1.000 O9 O 0.10100 -1.33900 0.03000 1.000 C10 C 1.35500 -1.88100 0.45100 1.000 C11 C 2.49000 -0.97700 -0.03400 1.000 O12 O -7.28700 -0.93700 0.02700 1.000 C13 C -8.67900 -1.05400 0.32900 1.000 C14 C -9.48000 -1.11300 -0.97300 1.000 O15 O -9.06200 -2.24400 -1.73900 1.000 C16 C -10.97000 -1.23800 -0.64900 1.000 O17 O -11.71900 -1.29300 -1.86500 1.000 C18 C -9.12600 0.15800 1.14900 1.000 C19 C -10.61600 0.03200 1.47300 1.000 C20 C -11.41800 -0.02600 0.17100 1.000 O21 O -12.81000 -0.14400 0.47300 1.000 O22 O -8.90100 1.35200 0.39700 1.000 H23 H -6.45100 -3.38400 -1.20100 1.000 H24 H -3.46700 -2.26000 1.55500 1.000 H25 H -3.54400 -3.20400 0.04800 1.000 H26 H -2.34200 -0.41000 0.28100 1.000 H27 H -1.78000 -0.40800 -3.18700 1.000 H28 H -2.25300 0.58300 -1.78600 1.000 H29 H -0.68100 -0.25300 -1.79600 1.000 H30 H -1.05800 -2.17700 1.52200 1.000 H31 H -0.95600 -3.11400 0.01200 1.000 H32 H 1.37800 -1.94100 1.53900 1.000 H33 H 1.47900 -2.87900 0.03000 1.000 H34 H 2.46700 -0.91700 -1.12200 1.000 H35 H 2.36500 0.02000 0.38700 1.000 H36 H -8.85100 -1.96400 0.90300 1.000 H37 H -9.30900 -0.20200 -1.54700 1.000 H38 H -9.53000 -2.34500 -2.57900 1.000 H39 H -11.14200 -2.14900 -0.07500 1.000 H40 H -12.67400 -1.37300 -1.73600 1.000 H41 H -8.55500 0.20000 2.07700 1.000 H42 H -10.78800 -0.87800 2.04700 1.000 H43 H -10.93500 0.89600 2.05700 1.000 H44 H -11.24600 0.88400 -0.40300 1.000 H45 H -13.16300 0.59200 0.99300 1.000 C46 C -8.62500 2.50100 1.20000 1.000 C47 C 3.83200 -1.55700 0.41700 1.000 C48 C 4.96700 -0.65300 -0.06800 1.000 C49 C 6.30900 -1.23300 0.38200 1.000 C50 C 7.44400 -0.32900 -0.10300 1.000 C51 C 8.78600 -0.91000 0.34800 1.000 C52 C 9.92100 -0.00600 -0.13700 1.000 C53 C 11.26400 -0.58600 0.31300 1.000 C54 C 12.39900 0.31800 -0.17200 1.000 C55 C 13.74100 -0.26200 0.27900 1.000 C56 C 14.87600 0.64200 -0.20600 1.000 C57 C 16.21800 0.06200 0.24500 1.000 C58 C 17.35300 0.96600 -0.24100 1.000 C59 C 18.69500 0.38600 0.21000 1.000 C60 C 19.83000 1.29000 -0.27500 1.000 C61 C 21.17200 0.71000 0.17600 1.000 C62 C 22.30700 1.61400 -0.31000 1.000 H63 H 3.85500 -1.61700 1.50500 1.000 H64 H 3.95700 -2.55500 -0.00500 1.000 H65 H 4.94400 -0.59400 -1.15700 1.000 H66 H 4.84300 0.34400 0.35300 1.000 H67 H 6.33200 -1.29300 1.47000 1.000 H68 H 6.43400 -2.23100 -0.03900 1.000 H69 H 7.42100 -0.27000 -1.19100 1.000 H70 H 7.32000 0.66800 0.31800 1.000 H71 H 8.80900 -0.96900 1.43600 1.000 H72 H 8.91100 -1.90700 -0.07300 1.000 H73 H 9.89800 0.05400 -1.22500 1.000 H74 H 9.79700 0.99200 0.28400 1.000 H75 H 11.28600 -0.64500 1.40100 1.000 H76 H 11.38800 -1.58300 -0.10800 1.000 H77 H 12.37600 0.37800 -1.26000 1.000 H78 H 12.27400 1.31600 0.25000 1.000 H79 H 13.76400 -0.32200 1.36700 1.000 H80 H 13.86500 -1.25900 -0.14200 1.000 H81 H 14.85300 0.70200 -1.29400 1.000 H82 H 14.75100 1.64000 0.21500 1.000 H83 H 16.24100 0.00200 1.33300 1.000 H84 H 16.34200 -0.93600 -0.17700 1.000 H85 H 17.33000 1.02600 -1.32900 1.000 H86 H 17.22800 1.96300 0.18100 1.000 H87 H 18.71800 0.32600 1.29800 1.000 H88 H 18.81900 -0.61200 -0.21100 1.000 H89 H 19.80700 1.34900 -1.36300 1.000 H90 H 19.70500 2.28700 0.14600 1.000 C91 C -8.40100 3.71400 0.29400 1.000 C92 C -8.22900 4.96800 1.15400 1.000 C93 C -8.00500 6.18000 0.24800 1.000 C94 C -6.74700 5.96300 -0.59500 1.000 C95 C -6.91900 4.70900 -1.45400 1.000 C96 C -7.14300 3.49600 -0.54900 1.000 H97 H -9.46800 2.69300 1.86200 1.000 H98 H -7.72900 2.32200 1.79400 1.000 H99 H 21.19500 0.65000 1.26400 1.000 H100 H 21.29700 -0.28800 -0.24600 1.000 H101 H 22.28400 1.67300 -1.39800 1.000 H102 H 22.18300 2.61100 0.11200 1.000 H103 H 23.26300 1.20000 0.01200 1.000 H104 H -9.26200 3.84000 -0.36300 1.000 H105 H -9.12500 5.12200 1.75400 1.000 H106 H -7.36900 4.84200 1.81100 1.000 H107 H -8.86600 6.30600 -0.40900 1.000 H108 H -7.88300 7.07400 0.86100 1.000 H109 H -6.58800 6.82700 -1.24000 1.000 H110 H -5.88700 5.83700 0.06300 1.000 H111 H -7.78000 4.83500 -2.11200 1.000 H112 H -6.02300 4.55400 -2.05500 1.000 H113 H -6.28300 3.37100 0.10900 1.000 H114 H -7.26600 2.60300 -1.16100 1.000