# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '91V' 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 1.74800 2.28000 -1.02100 1.000 C1 C 2.82900 2.73200 -0.03600 1.000 C2 C 3.22800 1.55200 0.85400 1.000 C3 C 1.98500 1.02800 1.58000 1.000 C4 C 4.59600 -1.87700 -1.20400 1.000 C5 C 4.70900 -4.24600 -0.87800 1.000 C6 C 4.87900 -2.76900 0.99900 1.000 C7 C 8.31900 0.81100 1.35100 1.000 C8 C 8.63500 1.42600 0.15400 1.000 C9 C 7.69800 1.48700 -0.86000 1.000 C10 C -4.21900 0.61300 -0.50600 1.000 C11 C -6.58800 0.02000 -0.90000 1.000 C12 C -8.88000 -0.56700 -1.29000 1.000 C13 C -2.95200 0.88000 -1.32100 1.000 C14 C -1.79600 1.20700 -0.37300 1.000 C15 C -0.52800 1.47400 -1.18800 1.000 N16 N 0.58100 1.78800 -0.27800 1.000 C17 C 0.93000 0.62500 0.54800 1.000 O18 O 3.78500 0.51200 0.04700 1.000 C19 C 4.76200 -0.28500 0.72000 1.000 C20 C 4.74500 -1.68200 0.15600 1.000 C21 C 4.57500 -3.15900 -1.72100 1.000 C22 C 4.86400 -4.05100 0.48200 1.000 C23 C 6.12800 0.32100 0.52100 1.000 C24 C 7.06700 0.25500 1.53400 1.000 C25 C 6.44500 0.93200 -0.67800 1.000 N26 N -5.32600 0.30000 -1.41300 1.000 C27 C -7.64400 -0.28600 -1.78000 1.000 C28 C -9.08500 -0.54900 0.10300 1.000 N29 N -10.13500 -0.77400 0.87700 1.000 N30 N -9.79300 -0.62600 2.11000 1.000 C31 C -8.52600 -0.30200 2.19100 1.000 N32 N -8.03600 -0.24200 0.93400 1.000 N33 N -6.77800 0.03700 0.39800 1.000 H34 H 1.45200 3.12100 -1.64700 1.000 H35 H 2.14200 1.48100 -1.65000 1.000 H36 H 3.70100 3.08200 -0.58800 1.000 H37 H 2.44100 3.54100 0.58300 1.000 H38 H 3.96600 1.88100 1.58600 1.000 H39 H 2.25500 0.16100 2.18300 1.000 H40 H 1.58400 1.81000 2.22500 1.000 H41 H 4.49100 -1.02700 -1.86300 1.000 H42 H 4.69300 -5.24700 -1.28100 1.000 H43 H 4.99600 -2.61700 2.06200 1.000 H44 H 9.05300 0.76000 2.14200 1.000 H45 H 9.61400 1.86000 0.01100 1.000 H46 H 7.94400 1.96800 -1.79500 1.000 H47 H -4.04900 -0.23000 0.16400 1.000 H48 H -4.46800 1.49800 0.07900 1.000 H49 H -9.69300 -0.80600 -1.95900 1.000 H50 H -2.70300 -0.00500 -1.90600 1.000 H51 H -3.12100 1.72300 -1.99100 1.000 H52 H -2.04500 2.09200 0.21200 1.000 H53 H -1.62600 0.36400 0.29700 1.000 H54 H -0.27900 0.58900 -1.77300 1.000 H55 H -0.69800 2.31700 -1.85800 1.000 H56 H 1.32700 -0.16600 -0.08800 1.000 H57 H 0.03800 0.26500 1.06200 1.000 H58 H 4.53200 -0.32000 1.78500 1.000 H59 H 4.45400 -3.31100 -2.78300 1.000 H60 H 4.96900 -4.90100 1.14100 1.000 H61 H 6.82200 -0.22900 2.46700 1.000 H62 H 5.71300 0.97900 -1.47000 1.000 H63 H -5.17900 0.28900 -2.37200 1.000 H64 H -7.47200 -0.29600 -2.84600 1.000 H65 H -7.97200 -0.11700 3.10000 1.000