# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0SG' 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 16.54900 -2.69700 0.73700 1.000 C1 C 15.20100 -2.42100 0.06800 1.000 C2 C 14.33300 -1.57100 0.99800 1.000 C3 C 12.98600 -1.29500 0.32900 1.000 C4 C 12.11800 -0.44500 1.26000 1.000 C5 C 10.77100 -0.16900 0.59000 1.000 C6 C 9.90300 0.68100 1.52100 1.000 C7 C 8.55600 0.95700 0.85100 1.000 C8 C 7.68800 1.80700 1.78200 1.000 C9 C 6.34100 2.08300 1.11200 1.000 C10 C 5.47300 2.93300 2.04300 1.000 C11 C 4.17500 3.31000 1.32700 1.000 C12 C 3.36100 4.25800 2.21100 1.000 C13 C 2.03100 4.53400 1.56000 1.000 C14 C 0.92000 4.26100 2.19800 1.000 C15 C -0.40700 4.42500 1.50300 1.000 O16 O -0.19100 4.84600 0.15500 1.000 C17 C -1.15400 3.09000 1.50800 1.000 C18 C -0.37700 2.06900 0.67400 1.000 O19 O -0.99900 0.78700 0.79000 1.000 C20 C -0.28700 -0.26600 0.13800 1.000 O21 O -0.37100 -0.09300 -1.27800 1.000 C22 C -0.90100 -1.61300 0.52300 1.000 O23 O -0.76600 -1.81400 1.93200 1.000 C24 C -0.17100 -2.73200 -0.22600 1.000 O25 O -0.78600 -3.98700 0.07200 1.000 S26 S -0.11800 -4.75100 1.20600 1.000 O27 O -0.71800 -6.03800 1.23200 1.000 O28 O 1.28100 -4.54800 1.05700 1.000 O29 O -0.51500 -4.06500 2.50600 1.000 C30 C -0.25700 -2.46400 -1.73200 1.000 O31 O -1.62400 -2.49900 -2.14600 1.000 C32 C 0.33300 -1.08300 -2.03000 1.000 C33 C 0.19700 -0.78200 -3.52400 1.000 O34 O 0.85900 0.44800 -3.82500 1.000 S35 S 0.68300 0.91000 -5.26400 1.000 O36 O 0.75400 -0.25700 -6.07200 1.000 O37 O -0.73800 1.43800 -5.39700 1.000 O38 O 1.54400 2.02800 -5.43500 1.000 N39 N -2.48900 3.27500 0.93400 1.000 C40 C -3.48900 2.43400 1.26800 1.000 O41 O -3.28300 1.52500 2.04400 1.000 C42 C -4.86200 2.62500 0.67700 1.000 C43 C -5.80300 1.54600 1.21700 1.000 C44 C -7.19700 1.73800 0.61700 1.000 C45 C -8.13800 0.65900 1.15600 1.000 C46 C -9.53300 0.85200 0.55700 1.000 C47 C -10.47400 -0.22700 1.09600 1.000 C48 C -11.86800 -0.03400 0.49700 1.000 C49 C -12.80900 -1.11300 1.03600 1.000 C50 C -14.20300 -0.92000 0.43700 1.000 C51 C -15.14400 -1.99900 0.97600 1.000 C52 C -16.53800 -1.80600 0.37700 1.000 H53 H 17.05300 -1.75300 0.94200 1.000 H54 H 16.38600 -3.23300 1.67300 1.000 H55 H 17.16600 -3.30300 0.07400 1.000 H56 H 15.36300 -1.88500 -0.86800 1.000 H57 H 14.69600 -3.36500 -0.13700 1.000 H58 H 14.17100 -2.10600 1.93400 1.000 H59 H 14.83800 -0.62700 1.20300 1.000 H60 H 13.14800 -0.75900 -0.60700 1.000 H61 H 12.48100 -2.23900 0.12400 1.000 H62 H 11.95600 -0.98000 2.19500 1.000 H63 H 12.62300 0.50000 1.46400 1.000 H64 H 10.93300 0.36700 -0.34500 1.000 H65 H 10.26700 -1.11300 0.38500 1.000 H66 H 9.74100 0.14600 2.45600 1.000 H67 H 10.40800 1.62600 1.72500 1.000 H68 H 8.71800 1.49300 -0.08400 1.000 H69 H 8.05200 0.01300 0.64600 1.000 H70 H 7.52600 1.27200 2.71700 1.000 H71 H 8.19300 2.75200 1.98600 1.000 H72 H 6.50300 2.61900 0.17700 1.000 H73 H 5.83700 1.13900 0.90700 1.000 H74 H 5.24000 2.36400 2.94300 1.000 H75 H 6.01400 3.84000 2.31600 1.000 H76 H 4.40900 3.80400 0.38400 1.000 H77 H 3.59400 2.40900 1.13000 1.000 H78 H 3.20000 3.79700 3.18500 1.000 H79 H 3.90600 5.19300 2.33700 1.000 H80 H 1.99300 4.95800 0.56700 1.000 H81 H 0.95500 3.91800 3.22100 1.000 H82 H -1.00100 5.17500 2.02700 1.000 H83 H 0.27500 4.19600 -0.39000 1.000 H84 H -1.24600 2.72800 2.53200 1.000 H85 H -0.37500 2.37900 -0.37100 1.000 H86 H 0.64900 2.00900 1.03700 1.000 H87 H 0.75900 -0.24200 0.44500 1.000 H88 H -1.95700 -1.62300 0.25300 1.000 H89 H -1.20600 -1.14100 2.46900 1.000 H90 H 0.87400 -2.75500 0.08200 1.000 H91 H 0.30800 -3.22500 -2.27000 1.000 H92 H -1.75300 -2.33600 -3.09000 1.000 H93 H 1.38700 -1.07000 -1.75100 1.000 H94 H 0.65000 -1.58900 -4.10000 1.000 H95 H -0.85900 -0.70000 -3.78300 1.000 H96 H -2.65400 4.00200 0.31300 1.000 H97 H -5.24200 3.60900 0.95100 1.000 H98 H -4.80400 2.54700 -0.40800 1.000 H99 H -5.42200 0.56200 0.94200 1.000 H100 H -5.86000 1.62300 2.30200 1.000 H101 H -7.57800 2.72300 0.89100 1.000 H102 H -7.14000 1.66100 -0.46900 1.000 H103 H -7.75800 -0.32500 0.88200 1.000 H104 H -8.19600 0.73700 2.24200 1.000 H105 H -9.91300 1.83600 0.83100 1.000 H106 H -9.47500 0.77500 -0.52900 1.000 H107 H -10.09300 -1.21100 0.82200 1.000 H108 H -10.53100 -0.14900 2.18200 1.000 H109 H -12.24800 0.95000 0.77100 1.000 H110 H -11.81000 -0.11100 -0.58900 1.000 H111 H -12.42800 -2.09700 0.76200 1.000 H112 H -12.86600 -1.03500 2.12200 1.000 H113 H -14.58300 0.06400 0.71100 1.000 H114 H -14.14600 -0.99700 -0.64900 1.000 H115 H -14.76400 -2.98300 0.70200 1.000 H116 H -15.20100 -1.92100 2.06200 1.000 H117 H -16.91900 -0.82200 0.65100 1.000 H118 H -16.48100 -1.88300 -0.70900 1.000 H119 H -17.20900 -2.57500 0.76100 1.000 H120 H -0.14000 -4.47500 3.29700 1.000 H121 H -0.93300 1.83000 -6.25900 1.000