# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'DR7' 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 9.92500 2.51700 1.19000 1.000 O1 O 8.93300 1.83800 0.37600 1.000 C2 C 7.62400 1.97500 0.65600 1.000 O3 O 7.27200 2.66700 1.59100 1.000 N4 N 6.70300 1.34500 -0.10000 1.000 C5 C 5.27800 1.49500 0.20500 1.000 C6 C 4.74400 2.76300 -0.46200 1.000 C7 C 4.84000 2.61900 -1.98200 1.000 C8 C 3.28200 2.97400 -0.06100 1.000 C9 C 5.57500 3.96600 -0.01100 1.000 C10 C 4.52400 0.29800 -0.31500 1.000 O11 O 4.96800 -0.34000 -1.24700 1.000 N12 N 3.35800 -0.06400 0.25500 1.000 C13 C 2.68800 -1.29700 -0.16700 1.000 C14 C 3.26600 -2.48200 0.60900 1.000 C15 C 4.71500 -2.66800 0.23700 1.000 C16 C 5.70100 -2.01600 0.95300 1.000 C17 C 7.03000 -2.18600 0.61100 1.000 C18 C 7.37200 -3.00900 -0.44600 1.000 C19 C 6.38500 -3.66200 -1.16100 1.000 C20 C 5.05700 -3.49500 -0.81600 1.000 C21 C 1.18900 -1.18500 0.11600 1.000 O22 O 0.98100 -0.98500 1.51600 1.000 C23 C 0.61100 0.00000 -0.66000 1.000 N24 N -0.85500 -0.09600 -0.68000 1.000 N25 N -1.16800 -1.15400 -1.48500 1.000 C26 C -2.30700 -1.84500 -1.27800 1.000 O27 O -2.63500 -2.72000 -2.05200 1.000 C28 C -3.17300 -1.53100 -0.08600 1.000 C29 C -2.63000 -2.25900 1.14500 1.000 C30 C -1.27700 -1.66100 1.53700 1.000 C31 C -3.61300 -2.10100 2.30700 1.000 C32 C -2.45600 -3.74500 0.82300 1.000 N33 N -4.54500 -1.97100 -0.34800 1.000 C34 C -5.57500 -1.38600 0.29300 1.000 O35 O -5.36600 -0.49200 1.08900 1.000 O36 O -6.83600 -1.79100 0.05200 1.000 C37 C -7.94700 -1.16000 0.74300 1.000 C38 C -1.34800 1.11000 -1.35800 1.000 C39 C -2.79800 1.32600 -1.00800 1.000 C40 C -3.13500 2.10600 0.08300 1.000 C41 C -4.46100 2.30700 0.40800 1.000 C42 C -3.78700 0.74800 -1.78400 1.000 C43 C -5.11600 0.93800 -1.46500 1.000 C44 C -5.46200 1.72200 -0.36600 1.000 C45 C -6.88900 1.93400 -0.02200 1.000 C46 C -7.82300 2.13200 -1.03700 1.000 C47 C -9.15100 2.32800 -0.70000 1.000 C48 C -9.50200 2.32100 0.64200 1.000 C49 C -8.52300 2.11900 1.59800 1.000 N50 N -7.26700 1.92900 1.25000 1.000 H51 H 9.75800 3.59300 1.14500 1.000 H52 H 9.84000 2.17900 2.22300 1.000 H53 H 10.92200 2.28800 0.81400 1.000 H54 H 6.98400 0.79200 -0.84600 1.000 H55 H 5.14300 1.56800 1.28500 1.000 H56 H 4.24800 1.76200 -2.30400 1.000 H57 H 4.45900 3.52300 -2.45800 1.000 H58 H 5.88100 2.46900 -2.26800 1.000 H59 H 3.20100 2.98300 1.02600 1.000 H60 H 2.93000 3.92500 -0.46000 1.000 H61 H 2.67500 2.16400 -0.46400 1.000 H62 H 6.61600 3.81600 -0.29600 1.000 H63 H 5.19400 4.87000 -0.48600 1.000 H64 H 5.50600 4.06900 1.07200 1.000 H65 H 2.96200 0.49200 0.94400 1.000 H66 H 2.84600 -1.45000 -1.23400 1.000 H67 H 3.18800 -2.28900 1.67900 1.000 H68 H 2.70900 -3.38600 0.36200 1.000 H69 H 5.43400 -1.37300 1.77800 1.000 H70 H 7.80100 -1.67600 1.17000 1.000 H71 H 8.41000 -3.14200 -0.71300 1.000 H72 H 6.65300 -4.30500 -1.98600 1.000 H73 H 4.28600 -4.00500 -1.37500 1.000 H74 H 0.69000 -2.10300 -0.19800 1.000 H75 H 1.43700 -0.16600 1.75100 1.000 H76 H 0.90700 0.93000 -0.17600 1.000 H77 H 0.99000 -0.01500 -1.68200 1.000 H78 H -0.57100 -1.40900 -2.20600 1.000 H79 H -3.16500 -0.45600 0.09600 1.000 H80 H -1.38700 -0.58900 1.70000 1.000 H81 H -0.92200 -2.13400 2.45300 1.000 H82 H -0.55800 -1.83400 0.73600 1.000 H83 H -4.57600 -2.52700 2.02800 1.000 H84 H -3.22600 -2.62000 3.18400 1.000 H85 H -3.73600 -1.04300 2.53600 1.000 H86 H -1.69000 -3.86400 0.05700 1.000 H87 H -2.15500 -4.27900 1.72400 1.000 H88 H -3.40000 -4.15000 0.45800 1.000 H89 H -4.71200 -2.68500 -0.98400 1.000 H90 H -7.82800 -1.29400 1.81800 1.000 H91 H -7.96300 -0.09600 0.50900 1.000 H92 H -8.88200 -1.61700 0.42000 1.000 H93 H -0.76400 1.97200 -1.03500 1.000 H94 H -1.24900 0.98700 -2.43600 1.000 H95 H -2.35900 2.55800 0.68300 1.000 H96 H -4.72300 2.91500 1.26100 1.000 H97 H -3.51800 0.14100 -2.63500 1.000 H98 H -5.88800 0.48300 -2.06900 1.000 H99 H -7.51400 2.13200 -2.07200 1.000 H100 H -9.89700 2.48400 -1.46500 1.000 H101 H -10.52900 2.47100 0.93800 1.000 H102 H -8.79300 2.11200 2.64400 1.000