# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9VL' 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 3.67800 -0.83600 0.05100 1.000 C1 C 4.39000 -3.11600 0.21700 1.000 C2 C 3.37400 -2.18100 0.14700 1.000 C3 C -8.45700 -0.33200 -0.17700 1.000 C4 C -7.23200 0.54300 -0.10600 1.000 C5 C -5.98100 -0.33500 -0.03800 1.000 C6 C -4.73400 0.54900 -0.09200 1.000 C7 C -3.48300 -0.33000 -0.02500 1.000 C8 C -2.23500 0.55400 -0.07900 1.000 C9 C 0.18500 0.27900 -0.04600 1.000 C10 C 2.57000 0.18300 -0.02600 1.000 C11 C 4.99800 -0.42500 0.03000 1.000 C12 C 6.01500 -1.36100 0.10000 1.000 C13 C 5.71000 -2.70600 0.19100 1.000 N14 N -7.30300 1.38800 1.09400 1.000 N15 N -1.03800 -0.28700 -0.01400 1.000 O16 O -9.11100 -0.53800 0.81800 1.000 O17 O -8.82200 -0.88300 -1.34500 1.000 O18 O 0.29400 1.48600 -0.12800 1.000 O19 O 1.28600 -0.49400 0.01400 1.000 Br20 Br 5.41400 1.41500 -0.09500 1.000 H21 H 4.15300 -4.16700 0.29300 1.000 H22 H 2.34300 -2.50200 0.16800 1.000 H23 H -7.18500 1.17500 -0.99300 1.000 H24 H -5.98500 -0.90200 0.89300 1.000 H25 H -5.97500 -1.02400 -0.88300 1.000 H26 H -4.73000 1.11500 -1.02300 1.000 H27 H -4.74000 1.23700 0.75200 1.000 H28 H -3.48700 -0.89600 0.90600 1.000 H29 H -3.47700 -1.01900 -0.86900 1.000 H30 H -2.23200 1.12100 -1.01000 1.000 H31 H -2.24200 1.24300 0.76600 1.000 H32 H 2.64600 0.86600 0.82000 1.000 H33 H 2.65600 0.74400 -0.95600 1.000 H34 H 7.04600 -1.04000 0.08300 1.000 H35 H 6.50400 -3.43700 0.24500 1.000 H36 H -7.34700 0.82500 1.93000 1.000 H37 H -6.52500 2.02900 1.13000 1.000 H38 H -1.12500 -1.25100 0.05200 1.000 H39 H -9.61500 -1.43600 -1.34100 1.000