# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C6V' 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 4.78300 -0.83900 0.64500 1.000 C1 C -2.49500 -4.25900 0.79000 1.000 C2 C -3.41900 -4.15600 -0.24700 1.000 C3 C -1.58200 1.83600 0.50200 1.000 C4 C 0.68700 -0.53500 1.69900 1.000 C5 C 1.66600 -0.38600 2.67500 1.000 C6 C 2.99700 -0.48400 2.33800 1.000 C7 C 3.36400 -0.73400 1.01000 1.000 C8 C 2.37400 -0.88400 0.03200 1.000 C9 C 1.04600 -0.78900 0.38000 1.000 C10 C 5.13500 -1.07600 -0.63800 1.000 C11 C 6.50400 -1.17700 -0.99100 1.000 C12 C -1.11400 2.56700 -0.59200 1.000 C13 C -0.71500 3.87600 -0.42400 1.000 C14 C -0.77800 4.46700 0.82800 1.000 C15 C -1.24100 3.74700 1.91800 1.000 C16 C -1.64700 2.43900 1.76100 1.000 C17 C -1.04500 1.92500 -1.95400 1.000 C18 C -3.69400 -2.92600 -0.80900 1.000 C19 C -3.04600 -1.77900 -0.34100 1.000 C20 C -2.11800 -1.88200 0.70100 1.000 C21 C -1.86000 -3.15200 1.26200 1.000 S22 S -3.18900 -0.10200 -0.85300 1.000 C23 C -2.01000 0.43400 0.32900 1.000 C24 C -1.55000 -0.59000 1.05200 1.000 O25 O -4.05100 -5.26800 -0.70600 1.000 O26 O -0.62400 -0.43800 2.03600 1.000 O27 O 7.36300 -1.05100 -0.13800 1.000 O28 O 6.85500 -1.41300 -2.27200 1.000 F29 F -0.38600 5.75000 0.98600 1.000 F30 F -2.34000 1.75000 -2.45300 1.000 C31 C -0.25100 2.82600 -2.90200 1.000 F32 F -0.41200 0.68200 -1.85200 1.000 H33 H 5.54500 -0.72300 1.40100 1.000 H34 H -2.28400 -5.22400 1.22600 1.000 H35 H 1.38200 -0.19200 3.69900 1.000 H36 H 3.75700 -0.36700 3.09600 1.000 H37 H 2.65200 -1.07700 -0.99400 1.000 H38 H 0.28100 -0.90500 -0.37400 1.000 H39 H 4.37300 -1.18800 -1.39500 1.000 H40 H -0.35300 4.44200 -1.27000 1.000 H41 H -1.29100 4.21400 2.89000 1.000 H42 H -2.00800 1.87900 2.61100 1.000 H43 H -4.41100 -2.84900 -1.61300 1.000 H44 H -1.14600 -3.24700 2.06700 1.000 H45 H -4.88100 -5.46600 -0.25000 1.000 H46 H 7.81000 -1.46600 -2.41500 1.000 H47 H 0.75800 2.96200 -2.51300 1.000 H48 H -0.20000 2.36200 -3.88700 1.000 H49 H -0.74400 3.79400 -2.98100 1.000