# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CJ2' 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 -5.02500 -1.13100 1.48400 1.000 C1 C -4.71600 -1.93300 -0.75900 1.000 C2 C -7.15500 -3.10000 -0.75500 1.000 C3 C 0.68800 2.07000 0.10500 1.000 C4 C 3.34700 1.55100 0.97700 1.000 C5 C 4.70300 1.31100 1.08200 1.000 C6 C 4.40200 -0.85700 0.10600 1.000 C7 C 5.23000 0.10900 0.64700 1.000 C8 C 4.98100 -2.16600 -0.36700 1.000 C9 C -1.32900 3.48200 -0.59100 1.000 C10 C -0.73100 2.29700 -0.18600 1.000 C11 C -1.62500 -0.02700 0.27100 1.000 C12 C -2.99000 -0.66400 0.31100 1.000 C13 C -3.77100 -0.55200 1.44700 1.000 C14 C -3.46500 -1.34800 -0.79300 1.000 C15 C -5.50000 -1.82600 0.38100 1.000 C16 C 2.51200 0.58100 0.43800 1.000 C17 C 3.04400 -0.62800 0.00700 1.000 F18 F 6.36400 -2.16800 -0.15500 1.000 F19 F 4.39800 -3.21800 0.34800 1.000 F20 F 4.71800 -2.32700 -1.73100 1.000 N21 N -2.63000 3.21000 -0.73400 1.000 N22 N -1.75500 1.38000 -0.11600 1.000 N23 N -2.84500 1.97600 -0.44900 1.000 N24 N 1.13800 0.82000 0.32900 1.000 O25 O -6.73100 -2.40100 0.41700 1.000 O26 O -0.71800 4.67600 -0.79600 1.000 O27 O 1.45900 3.01100 0.14300 1.000 H28 H -5.63300 -1.04600 2.37200 1.000 H29 H -5.08400 -2.47300 -1.61900 1.000 H30 H -8.15200 -3.50900 -0.59300 1.000 H31 H -7.17800 -2.41200 -1.60000 1.000 H32 H -6.45900 -3.91100 -0.96600 1.000 H33 H 2.93600 2.49000 1.31700 1.000 H34 H 5.35200 2.06300 1.50500 1.000 H35 H 6.29100 -0.07600 0.73100 1.000 H36 H -1.16500 -0.09200 1.25700 1.000 H37 H -1.00200 -0.54800 -0.45600 1.000 H38 H -3.40100 -0.01100 2.30500 1.000 H39 H -2.85800 -1.42400 -1.68300 1.000 H40 H 2.39700 -1.38400 -0.41300 1.000 H41 H 0.51000 0.08600 0.41600 1.000 H42 H -0.39900 4.80500 -1.69900 1.000