# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'F0D' 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 3.33600 -1.85300 -0.33400 1.000 C1 C 4.62000 -1.46700 -0.00800 1.000 C2 C 6.98500 0.76100 -0.55300 1.000 C3 C 6.26900 0.27500 0.70900 1.000 C4 C 4.86900 -0.15700 0.35800 1.000 C5 C 3.83300 0.75200 0.39900 1.000 C6 C 2.53900 0.36600 0.07600 1.000 C7 C 1.45500 1.40800 0.16700 1.000 C8 C 0.19000 0.95700 -0.56300 1.000 C9 C -0.14300 -0.46500 -0.11000 1.000 C10 C 2.29400 -0.93700 -0.30400 1.000 C11 C 0.92100 -1.40600 -0.68900 1.000 C12 C 0.68000 -2.85200 -0.28100 1.000 C13 C -0.73700 -3.30200 -0.68700 1.000 C14 C -1.72300 -2.35200 -0.04100 1.000 C15 C -1.48200 -2.31100 1.47000 1.000 C16 C -1.48200 -0.92800 -0.64700 1.000 C17 C -2.71000 -0.16300 -0.14100 1.000 C18 C -3.20100 -2.60100 -0.31700 1.000 O19 O -3.76500 -3.42000 0.71000 1.000 C20 C -3.86200 -1.18500 -0.33800 1.000 C21 C -4.86700 -1.07200 0.81100 1.000 C22 C -5.55700 0.26600 0.74500 1.000 C23 C -6.72100 0.40500 0.01800 1.000 C24 C -5.02400 1.35100 1.41700 1.000 C25 C -5.65400 2.58200 1.36700 1.000 C26 C -6.81900 2.73400 0.64400 1.000 C27 C -7.35900 1.64400 -0.04100 1.000 C28 C -8.60800 1.80000 -0.81800 1.000 O29 O -9.07600 0.85000 -1.41300 1.000 N30 N -9.22700 2.99600 -0.86500 1.000 H31 H 3.14100 -2.87700 -0.61900 1.000 H32 H 5.42600 -2.18500 -0.03800 1.000 H33 H 7.02700 -0.04900 -1.28100 1.000 H34 H 6.44000 1.60400 -0.97800 1.000 H35 H 6.81400 -0.56700 1.13500 1.000 H36 H 6.22700 1.08500 1.43800 1.000 H37 H 4.03100 1.77500 0.68600 1.000 H38 H 1.21700 1.58500 1.21600 1.000 H39 H 1.81300 2.33500 -0.27900 1.000 H40 H -0.63500 1.62400 -0.31500 1.000 H41 H 0.36300 0.96900 -1.63900 1.000 H42 H -0.14600 -0.51300 0.97900 1.000 H43 H 0.84300 -1.35900 -1.77500 1.000 H44 H 1.41400 -3.49100 -0.77100 1.000 H45 H 0.79000 -2.94300 0.80000 1.000 H46 H -0.84100 -3.26200 -1.77100 1.000 H47 H -0.91700 -4.31800 -0.33400 1.000 H48 H -0.43900 -2.06400 1.66500 1.000 H49 H -2.12600 -1.55500 1.92000 1.000 H50 H -1.71200 -3.28600 1.90100 1.000 H51 H -1.46800 -0.95000 -1.73600 1.000 H52 H -2.59800 0.09400 0.91200 1.000 H53 H -2.88100 0.73100 -0.74100 1.000 H54 H -3.32900 -3.07500 -1.29000 1.000 H55 H -4.70500 -3.61200 0.58700 1.000 H56 H -4.36100 -1.00800 -1.29100 1.000 H57 H -5.60700 -1.86700 0.72600 1.000 H58 H -4.34200 -1.16400 1.76200 1.000 H59 H -7.13800 -0.44400 -0.50300 1.000 H60 H -4.11200 1.23700 1.98500 1.000 H61 H -5.23600 3.42400 1.89700 1.000 H62 H -7.31100 3.69500 0.60500 1.000 H63 H -8.85400 3.75500 -0.39000 1.000 H64 H -10.04600 3.09900 -1.37500 1.000 Br65 Br 8.81100 1.32600 -0.09400 1.000