# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CDD' 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 7.72600 -0.09100 -1.52300 1.000 N1 N 6.49100 -0.44900 -1.22200 1.000 C2 C 6.14500 -0.77700 0.00800 1.000 C3 C 7.07500 -0.76600 1.03100 1.000 C4 C 8.38100 -0.39600 0.75200 1.000 C5 C 8.70700 -0.05300 -0.55100 1.000 C6 C 4.72200 -1.17700 0.30000 1.000 C7 C 3.80500 0.03700 0.12800 1.000 F8 F 4.33000 -2.18600 -0.58600 1.000 F9 F 4.62900 -1.64800 1.61400 1.000 N10 N 2.44200 -0.32100 0.52700 1.000 C11 C 1.42600 0.62600 0.45700 1.000 C12 C 0.05700 0.27700 0.84800 1.000 N13 N -0.89800 1.23000 0.76900 1.000 C14 C -0.56000 2.47300 0.32200 1.000 C15 C 0.71300 2.75800 -0.03600 1.000 N16 N 1.68000 1.84600 0.03300 1.000 C17 C -2.27900 0.93000 1.15500 1.000 C18 C -3.03700 0.42400 -0.04600 1.000 N19 N -4.33500 0.08300 0.07100 1.000 C20 C -5.07200 -0.40800 -1.09600 1.000 C21 C -6.49300 -0.71700 -0.69900 1.000 C22 C -7.51500 0.13700 -1.07000 1.000 C23 C -8.81800 -0.14600 -0.70700 1.000 C24 C -9.10100 -1.28300 0.02700 1.000 C25 C -8.08100 -2.13800 0.39900 1.000 C26 C -6.77600 -1.85800 0.03100 1.000 O27 O -0.21200 -0.84500 1.24400 1.000 Cl28 Cl -1.77900 3.70400 0.20900 1.000 O29 O -2.47800 0.32400 -1.11800 1.000 F30 F -5.77800 -2.69400 0.39400 1.000 O31 O 5.51200 -0.47600 -2.24500 1.000 H32 H 7.97200 0.17500 -2.54100 1.000 H33 H 6.78600 -1.03900 2.03500 1.000 H34 H 9.12800 -0.37600 1.53200 1.000 H35 H 9.71600 0.24000 -0.80400 1.000 H36 H 4.16400 0.85400 0.75300 1.000 H37 H 3.80800 0.34900 -0.91600 1.000 H38 H 2.24700 -1.21800 0.84000 1.000 H39 H 0.95000 3.75100 -0.38800 1.000 H40 H -2.28200 0.16700 1.93300 1.000 H41 H -2.75600 1.83500 1.53100 1.000 H42 H -4.78200 0.16300 0.92900 1.000 H43 H -5.07000 0.35400 -1.87400 1.000 H44 H -4.59500 -1.31300 -1.47200 1.000 H45 H -7.29500 1.02600 -1.64300 1.000 H46 H -9.61600 0.52200 -0.99700 1.000 H47 H -10.12000 -1.50300 0.31100 1.000 H48 H -8.30300 -3.02500 0.97300 1.000