# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9FE' 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 -2.62500 -1.30200 -0.00100 1.000 O1 O -3.00700 2.26900 -0.00000 1.000 C2 C -3.31600 1.09400 -0.00000 1.000 O3 O -4.61500 0.73800 0.00000 1.000 C4 C -2.26700 0.05600 -0.00100 1.000 C5 C -0.92700 0.42500 -0.00000 1.000 C6 C 0.05700 -0.56600 -0.00100 1.000 C7 C 1.51800 -0.54300 -0.00100 1.000 Br8 Br 2.60900 1.00200 0.00000 1.000 N9 N 1.93300 -1.77700 -0.00100 1.000 N10 N 0.84200 -2.65200 -0.00100 1.000 C11 C -0.31700 -1.92500 -0.00100 1.000 C12 C -1.66900 -2.27200 0.00500 1.000 H13 H -3.66800 -1.57900 -0.00000 1.000 H14 H -5.26600 1.45300 0.00000 1.000 H15 H -0.64900 1.46800 -0.00100 1.000 H16 H -1.95800 -3.31200 0.00400 1.000 H17 H 0.89800 -3.62000 -0.00100 1.000