# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CFJ' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N -6.96100 0.01500 0.14900 1.000 C1 C -5.76000 0.67500 -0.07800 1.000 C2 C -5.65300 2.05100 0.05500 1.000 C3 C -4.44300 2.67200 -0.17900 1.000 C4 C -3.32600 1.92900 -0.54800 1.000 C5 C 1.37600 1.53100 1.35700 1.000 C6 C 3.97600 1.57200 -0.08200 1.000 C7 C 8.54400 0.64600 0.68600 1.000 C8 C 8.38100 -0.70700 0.37300 1.000 C9 C 9.45600 -1.62800 0.58600 1.000 C10 C 7.16400 -1.15800 -0.14800 1.000 C11 C 6.13100 -0.26800 -0.35200 1.000 C12 C -4.63400 -0.07900 -0.45100 1.000 C13 C -8.21800 0.88600 2.05700 1.000 C14 C -8.14900 0.78100 0.53300 1.000 N15 N -2.10500 2.57500 -0.78300 1.000 C16 C -0.94800 1.97400 -0.44200 1.000 O17 O -0.95800 0.84100 -0.00900 1.000 C18 C 0.35800 2.70900 -0.59700 1.000 C19 C 1.50800 1.80900 -0.14200 1.000 C20 C 2.84200 2.50700 -0.41600 1.000 O21 O 3.74000 0.45700 0.33400 1.000 N22 N 5.25100 1.97500 -0.24600 1.000 C23 C 6.29900 1.07600 -0.03900 1.000 C24 C 7.50800 1.52800 0.48000 1.000 N25 N 10.30900 -2.35900 0.75600 1.000 Cl26 Cl 6.95400 -2.83700 -0.54000 1.000 C27 C -3.41600 0.55300 -0.68500 1.000 C28 C -4.78500 -1.54000 -0.58300 1.000 O29 O -3.84200 -2.23800 -0.90200 1.000 N30 N -5.99800 -2.08200 -0.33900 1.000 C31 C -6.17400 -3.53100 -0.46400 1.000 C32 C -5.88500 -4.19800 0.88300 1.000 C33 C -7.04400 -1.32000 0.01400 1.000 O34 O -8.11400 -1.86000 0.22200 1.000 H35 H -6.51500 2.63500 0.34100 1.000 H36 H -4.36300 3.74400 -0.07400 1.000 H37 H 0.42600 1.03400 1.55200 1.000 H38 H 2.19500 0.88900 1.68100 1.000 H39 H 1.41300 2.47200 1.90500 1.000 H40 H 9.48100 0.99700 1.09300 1.000 H41 H 5.19100 -0.61500 -0.75400 1.000 H42 H -7.32500 1.39000 2.42800 1.000 H43 H -9.10200 1.45600 2.34300 1.000 H44 H -8.27600 -0.11400 2.48800 1.000 H45 H -8.09100 1.78100 0.10200 1.000 H46 H -9.04200 0.27700 0.16200 1.000 H47 H -2.09200 3.45500 -1.19100 1.000 H48 H 0.50000 2.98000 -1.64300 1.000 H49 H 0.34100 3.61300 0.01200 1.000 H50 H 1.47100 0.86700 -0.69100 1.000 H51 H 2.91600 3.40300 0.20000 1.000 H52 H 2.89700 2.78400 -1.46900 1.000 H53 H 5.44200 2.88900 -0.50700 1.000 H54 H 7.63300 2.57200 0.72600 1.000 H55 H -2.54900 -0.02300 -0.97200 1.000 H56 H -7.20000 -3.74800 -0.76300 1.000 H57 H -5.48700 -3.91800 -1.21600 1.000 H58 H -4.85900 -3.98100 1.18200 1.000 H59 H -6.57200 -3.81100 1.63500 1.000 H60 H -6.01600 -5.27600 0.79000 1.000