# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '981' 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 -7.38400 -1.50300 0.61900 1.000 C1 C -6.62500 -1.75500 -0.51100 1.000 C2 C -5.38200 -1.17100 -0.65500 1.000 C3 C 7.52300 -1.21600 1.43400 1.000 C4 C 8.76600 -2.10900 1.45900 1.000 C5 C -6.90300 -0.66500 1.61000 1.000 C6 C -5.66200 -0.07600 1.47700 1.000 C7 C -4.89200 -0.32600 0.34200 1.000 C8 C -3.55900 0.30400 0.19400 1.000 C9 C -2.42200 -0.43700 0.37200 1.000 C10 C -1.16400 0.19100 0.22400 1.000 C11 C 0.03100 -0.52400 0.39700 1.000 C12 C 3.62600 -0.03400 -0.62700 1.000 C13 C 4.78900 -0.77900 -0.56800 1.000 C14 C 5.94200 -0.22600 -0.02100 1.000 C15 C 8.20100 -0.33100 -0.71400 1.000 C16 C 9.44400 -1.22400 -0.68900 1.000 C17 C -3.44600 1.72300 -0.15000 1.000 C18 C -1.08900 1.56200 -0.10200 1.000 C19 C 1.20800 1.40600 -0.06100 1.000 C20 C 3.61200 1.26900 -0.14600 1.000 C21 C 4.76500 1.82200 0.39500 1.000 C22 C 5.92400 1.07400 0.46500 1.000 C23 C -2.13900 3.71600 -0.63100 1.000 C24 C -2.11000 4.55200 0.65100 1.000 F25 F 4.80500 -2.04400 -1.04000 1.000 N26 N 9.84700 -1.46000 0.70500 1.000 N27 N 1.17600 0.11400 0.24700 1.000 N28 N 7.12000 -0.98000 0.04100 1.000 N29 N -2.23500 2.29600 -0.28500 1.000 N30 N 0.10800 2.12200 -0.23400 1.000 N31 N 2.43400 2.02500 -0.20600 1.000 O32 O -4.45300 2.38800 -0.31500 1.000 Cl33 Cl -8.94900 -2.23500 0.79000 1.000 Cl34 Cl -4.43000 -1.48900 -2.07100 1.000 H35 H -7.00500 -2.41000 -1.28100 1.000 H36 H 6.71000 -1.70900 1.96900 1.000 H37 H 9.08300 -2.26100 2.49100 1.000 H38 H -7.50000 -0.47200 2.48900 1.000 H39 H -5.28800 0.57700 2.25200 1.000 H40 H -2.48400 -1.48600 0.62300 1.000 H41 H 0.01300 -1.57400 0.64800 1.000 H42 H 2.73100 -0.46200 -1.05300 1.000 H43 H 8.43500 0.63100 -0.25900 1.000 H44 H 7.88400 -0.17900 -1.74500 1.000 H45 H 9.21800 -2.17600 -1.16800 1.000 H46 H 10.25700 -0.73100 -1.22300 1.000 H47 H 4.75300 2.83600 0.77000 1.000 H48 H 6.82000 1.50500 0.88600 1.000 H49 H -3.00100 4.00300 -1.23200 1.000 H50 H -1.22500 3.89100 -1.19900 1.000 H51 H -2.03800 5.60900 0.39400 1.000 H52 H -3.02300 4.37700 1.21900 1.000 H53 H -1.24700 4.26500 1.25200 1.000 H54 H 10.69600 -2.00300 0.74900 1.000 H55 H 2.48000 2.98300 -0.35000 1.000 H56 H 7.74900 -0.26400 1.91400 1.000 H57 H 8.53200 -3.07100 1.00500 1.000