# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0WG' 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 4.46400 1.20600 0.41600 1.000 N1 N 3.32000 0.35400 0.08200 1.000 C2 C 2.06000 0.91500 -0.03600 1.000 N3 N 1.86400 2.20900 0.14700 1.000 C4 C 0.66100 2.75500 0.03600 1.000 N5 N 0.51500 4.11700 0.23900 1.000 C6 C -0.45900 1.99100 -0.28000 1.000 C7 C -1.81500 2.63900 -0.40000 1.000 N8 N -2.02800 3.07400 -1.78700 1.000 C9 C -0.31200 0.62100 -0.48400 1.000 C10 C -1.47500 -0.23200 -0.82200 1.000 C11 C -1.82400 -0.44300 -2.15600 1.000 C12 C -2.90800 -1.23900 -2.46500 1.000 C13 C -3.64900 -1.82700 -1.45600 1.000 C14 C -3.31000 -1.62000 -0.13100 1.000 C15 C -2.22300 -0.83100 0.19100 1.000 Br16 Br -1.75500 -0.55700 2.00300 1.000 C17 C 0.98000 0.07400 -0.35800 1.000 C18 C 1.23700 -1.35600 -0.55400 1.000 O19 O 0.33300 -2.12100 -0.83400 1.000 N20 N 2.50500 -1.80300 -0.41600 1.000 C21 C 2.79200 -3.22600 -0.61200 1.000 C22 C 3.50600 -0.96300 -0.11200 1.000 O23 O 4.63000 -1.41400 0.00100 1.000 H24 H 4.58000 1.25000 1.49900 1.000 H25 H 5.36800 0.79100 -0.03000 1.000 H26 H 4.29500 2.21000 0.02700 1.000 H27 H 1.28800 4.66100 0.45900 1.000 H28 H -0.36000 4.52900 0.16000 1.000 H29 H -2.58600 1.92100 -0.12200 1.000 H30 H -1.86500 3.50200 0.26400 1.000 H31 H -1.92200 2.30200 -2.42800 1.000 H32 H -2.93100 3.51100 -1.89300 1.000 H33 H -1.24600 0.01500 -2.94500 1.000 H34 H -3.17800 -1.40300 -3.49800 1.000 H35 H -4.49700 -2.44800 -1.70300 1.000 H36 H -3.89300 -2.08100 0.65300 1.000 H37 H 3.85900 -3.40400 -0.47200 1.000 H38 H 2.22700 -3.81400 0.11100 1.000 H39 H 2.50500 -3.51900 -1.62200 1.000