# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CVV' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N 0.55900 0.71000 0.37800 1.000 C1 C -4.73000 1.03100 -1.30800 1.000 C2 C -3.36600 1.35300 -0.71200 1.000 C3 C -2.24000 1.28200 -1.67600 1.000 C4 C -1.08900 0.78300 -1.35500 1.000 C5 C -0.72800 0.16100 -0.05600 1.000 C6 C 3.00800 0.72100 0.36400 1.000 C7 C 5.44200 1.75100 1.19200 1.000 C8 C 3.04800 1.80000 1.24800 1.000 C9 C -3.15600 0.47300 0.49700 1.000 C10 C -2.62400 -3.13300 0.68500 1.000 C11 C -3.47900 -3.60300 -0.31000 1.000 C12 C -4.19600 0.83800 1.56000 1.000 C13 C -7.10600 1.15000 -0.84100 1.000 C14 C -9.60100 1.71500 -0.29500 1.000 I15 I 7.19900 -0.15500 -0.38200 1.000 C16 C -4.24000 -2.77300 -1.11800 1.000 C17 C 4.19900 0.16300 -0.10100 1.000 C18 C 5.40900 0.68000 0.31500 1.000 C19 C 4.26400 2.30800 1.65700 1.000 C20 C -1.74800 0.37700 1.06800 1.000 C21 C -3.38700 -0.95700 0.07600 1.000 C22 C -2.56700 -1.74800 0.87100 1.000 O23 O 1.67600 -0.77500 -0.84000 1.000 C24 C -4.18800 -1.40000 -0.94800 1.000 N25 N -5.75500 1.33600 -0.29500 1.000 C26 C -5.58000 0.57600 0.94500 1.000 C27 C -8.13500 1.70800 0.14300 1.000 C28 C -9.12500 0.72200 0.76600 1.000 O29 O -1.83100 -0.95100 1.70500 1.000 C30 C -4.89100 -0.39700 -1.80300 1.000 O31 O -1.87900 -3.98300 1.44200 1.000 C32 C 1.70800 0.16800 -0.07300 1.000 H33 H 0.58500 1.46400 0.98600 1.000 H34 H -4.88300 1.70200 -2.15400 1.000 H35 H -3.41300 2.38100 -0.35100 1.000 H36 H -2.38600 1.65800 -2.67800 1.000 H37 H -0.31500 0.82300 -2.10700 1.000 H38 H -0.61000 -0.91100 -0.20900 1.000 H39 H 6.39100 2.15200 1.51500 1.000 H40 H 2.13000 2.23700 1.61200 1.000 H41 H -3.55300 -4.67000 -0.46000 1.000 H42 H -4.05900 0.21500 2.44400 1.000 H43 H -4.10100 1.89000 1.82700 1.000 H44 H -7.18900 1.67600 -1.79200 1.000 H45 H -7.29100 0.08700 -0.99700 1.000 H46 H -10.22200 2.54700 0.03700 1.000 H47 H -9.83200 1.32200 -1.28500 1.000 H48 H -4.87400 -3.19700 -1.88100 1.000 H49 H 4.17500 -0.67200 -0.78500 1.000 H50 H 4.29600 3.14300 2.34200 1.000 H51 H -1.48500 1.19300 1.74100 1.000 H52 H -5.68100 -0.48800 0.73000 1.000 H53 H -6.35000 0.87200 1.65700 1.000 H54 H -7.79100 2.53600 0.76400 1.000 H55 H -9.43200 0.90000 1.79700 1.000 H56 H -9.04200 -0.32500 0.47500 1.000 H57 H -5.95300 -0.64100 -1.82700 1.000 H58 H -4.49700 -0.46200 -2.81700 1.000 H59 H -2.32100 -4.28000 2.24900 1.000