# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C1D' 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 7.81300 -5.91600 -4.45500 1.000 N1 N 6.65000 -5.22700 -4.42400 1.000 C2 C 5.57200 -5.92200 -4.02200 1.000 C3 C 5.57200 -7.24800 -3.65100 1.000 C4 C 6.78700 -7.92300 -3.69600 1.000 C5 C 7.93400 -7.25100 -4.10400 1.000 C6 C 4.27000 -5.15800 -3.98600 1.000 C7 C 4.06000 -4.50400 -2.62100 1.000 F8 F 4.22400 -4.18300 -4.94100 1.000 F9 F 3.19800 -5.96300 -4.24500 1.000 N10 N 2.82200 -3.78600 -2.60500 1.000 C11 C 2.41200 -3.13700 -1.46300 1.000 C12 C 1.06900 -2.40600 -1.57600 1.000 N13 N 0.55900 -1.93800 -0.27700 1.000 C14 C 1.44600 -1.94900 0.80000 1.000 C15 C 2.66100 -2.50500 0.72800 1.000 N16 N 3.14400 -3.14700 -0.38000 1.000 C17 C -0.77700 -1.40700 -0.25800 1.000 C18 C -1.67500 -2.14800 0.71900 1.000 N19 N -3.04400 -1.61600 0.72100 1.000 C20 C -3.88300 -2.29100 1.65000 1.000 C21 C -5.29500 -1.70100 1.59300 1.000 C22 C -5.85800 -1.86200 0.17200 1.000 C23 C -7.29200 -1.34800 0.09300 1.000 C24 C -5.79000 -2.11300 4.06800 1.000 C25 C -8.16600 -2.00600 1.16300 1.000 C26 C -6.25100 -2.34400 2.62700 1.000 O27 O 0.16000 -3.32100 -2.17600 1.000 N28 N -9.51300 -1.44500 1.10000 1.000 Cl29 Cl 0.91300 -1.20200 2.25800 1.000 N30 N -7.60700 -1.78600 2.49600 1.000 H31 H 8.67800 -5.34700 -4.78100 1.000 H32 H 4.66900 -7.76000 -3.33400 1.000 H33 H 6.84000 -8.96900 -3.41200 1.000 H34 H 8.89200 -7.75600 -4.14700 1.000 H35 H 4.87300 -3.80400 -2.39900 1.000 H36 H 4.03500 -5.25900 -1.82800 1.000 H37 H 2.22000 -3.72300 -3.38400 1.000 H38 H 1.19800 -1.55600 -2.25600 1.000 H39 H 3.33100 -2.49700 1.58100 1.000 H40 H -0.70300 -0.34400 -0.00500 1.000 H41 H -1.17300 -1.49600 -1.27400 1.000 H42 H -1.74100 -3.20500 0.44500 1.000 H43 H -1.29300 -2.07800 1.74300 1.000 H44 H -2.98900 -0.60900 0.93700 1.000 H45 H -3.93800 -3.33900 1.39200 1.000 H46 H -3.49300 -2.16300 2.64900 1.000 H47 H -5.20900 -0.62800 1.81100 1.000 H48 H -5.83400 -2.92000 -0.12100 1.000 H49 H -5.23200 -1.31800 -0.54600 1.000 H50 H -7.29000 -0.25600 0.21700 1.000 H51 H -7.69500 -1.55300 -0.90700 1.000 H52 H -6.56200 -1.58900 4.63900 1.000 H53 H -5.58300 -3.06700 4.56300 1.000 H54 H -4.87800 -1.50900 4.08800 1.000 H55 H -8.24300 -3.08300 0.96800 1.000 H56 H -6.29100 -3.42900 2.46400 1.000 H57 H -0.25700 -3.81500 -1.45300 1.000 H58 H -10.11400 -1.57700 1.88400 1.000 H59 H -9.85000 -1.13400 0.21400 1.000 H60 H -8.21900 -2.21500 3.18900 1.000