# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9G1' 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 10.78800 -1.19900 3.73500 1.000 C1 C 7.70800 -0.80900 -2.23700 1.000 C2 C 7.95600 -2.72400 0.27100 1.000 C3 C 9.19800 -3.52300 -0.12900 1.000 C4 C 3.88800 2.87700 1.40500 1.000 C5 C 2.10900 3.99700 0.43300 1.000 C6 C 5.35800 -1.63200 0.17400 1.000 C7 C 5.76200 -0.18300 0.26200 1.000 C8 C 4.61200 0.63200 0.85900 1.000 C9 C 6.16700 2.19900 1.85900 1.000 C10 C 7.36300 1.43100 1.29100 1.000 C11 C 6.99600 -0.05000 1.15900 1.000 C12 C 9.86500 -0.78000 1.47200 1.000 C13 C 9.56800 -1.34700 2.86200 1.000 C14 C 8.74300 -0.28300 -1.24000 1.000 C15 C 8.08700 -0.37500 -3.63000 1.000 C16 C 8.84000 -4.98200 -0.24900 1.000 C17 C 1.27800 4.09900 -0.84700 1.000 C18 C -4.98800 -0.67500 -2.06500 1.000 C19 C -5.83000 -1.18400 -0.89400 1.000 C20 C -7.62500 -0.69800 0.45200 1.000 C21 C -8.15300 -1.80000 -0.49700 1.000 C22 C -6.94400 -2.12700 -1.40100 1.000 C23 C -8.89200 1.44300 0.02500 1.000 C24 C -10.38600 1.39400 1.59600 1.000 C25 C -11.43400 1.59400 2.51100 1.000 C26 C -10.87400 -0.39800 3.53500 1.000 C27 C -9.60800 0.23100 1.72200 1.000 C28 C 3.27900 5.02000 0.41700 1.000 C29 C 4.29700 4.36200 1.38000 1.000 N30 N 4.99100 -2.15800 -1.01200 1.000 N31 N 5.01300 2.04100 0.96500 1.000 N32 N -8.67100 0.29200 0.72200 1.000 N33 N -9.89900 2.08800 0.54000 1.000 N34 N -12.23800 2.71700 2.43300 1.000 N35 N -11.63500 0.67800 3.45300 1.000 N36 N -9.88700 -0.63000 2.69600 1.000 O37 O 5.36300 -2.32500 1.16900 1.000 O38 O 10.75900 -1.63100 5.00500 1.000 O39 O 11.79200 -0.69600 3.29000 1.000 O40 O 9.08200 0.28700 -3.80700 1.000 O41 O 7.31900 -0.72500 -4.67400 1.000 O42 O 9.77900 -5.87800 -0.59200 1.000 O43 O 7.70800 -5.34500 -0.03500 1.000 O44 O 2.78000 2.72000 0.50300 1.000 O45 O 0.20400 3.15800 -0.79400 1.000 O46 O -0.17100 2.72700 -3.25300 1.000 O47 O -1.73900 4.34200 -2.11100 1.000 O48 O -1.85400 1.75800 -1.64100 1.000 O49 O -3.52200 1.66200 -3.53300 1.000 O50 O -1.96000 -0.30300 -3.27000 1.000 O51 O -3.91600 0.12900 -1.56800 1.000 O52 O -6.52900 -0.08800 -0.26400 1.000 O53 O -8.54900 -2.95400 0.24700 1.000 O54 O -10.16400 -4.75600 1.27500 1.000 O55 O -10.99900 -2.46900 0.60800 1.000 O56 O -10.39900 -4.06800 -1.25200 1.000 O57 O -6.55400 -3.49300 -1.24300 1.000 O58 O 2.85200 6.29000 0.91400 1.000 O59 O 4.19100 4.93200 2.68600 1.000 P60 P 8.39000 -0.95900 0.41500 1.000 P61 P -0.87400 2.99000 -1.97800 1.000 P62 P -2.82800 0.83000 -2.52500 1.000 P63 P -10.04900 -3.53800 0.22800 1.000 H64 H 7.68100 -1.89800 -2.19100 1.000 H65 H 6.72600 -0.41000 -1.98700 1.000 H66 H 7.18400 -2.84800 -0.48800 1.000 H67 H 7.58500 -3.08600 1.23000 1.000 H68 H 9.57000 -3.16100 -1.08800 1.000 H69 H 9.97000 -3.39900 0.63000 1.000 H70 H 3.58700 2.59200 2.41400 1.000 H71 H 1.48100 4.14800 1.31100 1.000 H72 H 5.99400 0.19200 -0.73500 1.000 H73 H 3.73700 0.55100 0.21600 1.000 H74 H 4.37200 0.24800 1.85100 1.000 H75 H 5.91900 1.80700 2.84600 1.000 H76 H 6.42100 3.25600 1.94100 1.000 H77 H 7.62000 1.83100 0.31100 1.000 H78 H 8.21500 1.53600 1.96300 1.000 H79 H 6.77600 -0.46000 2.14400 1.000 H80 H 10.12400 0.27500 1.55800 1.000 H81 H 10.69800 -1.32300 1.02700 1.000 H82 H 9.30900 -2.40200 2.77500 1.000 H83 H 8.73500 -0.80400 3.30600 1.000 H84 H 9.74000 -0.59200 -1.55400 1.000 H85 H 8.69300 0.80600 -1.20700 1.000 H86 H 0.87300 5.10700 -0.93800 1.000 H87 H 1.90900 3.88200 -1.70900 1.000 H88 H -4.58000 -1.52400 -2.61500 1.000 H89 H -5.61200 -0.07800 -2.73000 1.000 H90 H -5.19900 -1.69800 -0.16900 1.000 H91 H -7.27100 -1.13800 1.38400 1.000 H92 H -8.98500 -1.42500 -1.09300 1.000 H93 H -7.17800 -1.91400 -2.44400 1.000 H94 H -8.31400 1.77300 -0.82600 1.000 H95 H -11.07300 -1.11700 4.31500 1.000 H96 H 3.69800 5.11600 -0.58400 1.000 H97 H 5.31100 4.47200 0.99600 1.000 H98 H 4.73100 -3.09100 -1.06900 1.000 H99 H 4.98600 -1.60400 -1.80800 1.000 H100 H -12.08100 3.37900 1.74000 1.000 H101 H -12.95800 2.84400 3.07000 1.000 H102 H 11.56500 -1.51400 5.52700 1.000 H103 H 7.60200 -0.42300 -5.54800 1.000 H104 H 9.50200 -6.80200 -0.65600 1.000 H105 H -2.22800 4.57700 -1.31000 1.000 H106 H -1.47700 -0.88700 -2.66900 1.000 H107 H -11.04300 -5.15700 1.31600 1.000 H108 H -9.81500 -4.77100 -1.56600 1.000 H109 H -5.79900 -3.75200 -1.78800 1.000 H110 H 3.54700 6.96200 0.92300 1.000 H111 H 4.38100 5.88000 2.71800 1.000