# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'F79' 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 2.92100 -1.63100 0.60800 1.000 C1 C 2.87800 -1.65200 2.00200 1.000 C2 C 1.80000 -1.07900 2.67600 1.000 C3 C 0.76400 -0.48400 1.95500 1.000 C4 C 0.80700 -0.46300 0.56100 1.000 C5 C 1.88500 -1.03600 -0.11200 1.000 C6 C -0.40000 0.13500 2.65700 1.000 C7 C -1.53200 -0.86100 2.89000 1.000 O8 O 1.75300 -1.09600 4.03900 1.000 C9 C 2.34400 0.00700 4.72000 1.000 C10 C 1.62200 0.23300 6.03600 1.000 N11 N 2.25600 1.35500 6.76500 1.000 C12 C 3.95900 -2.27200 2.76300 1.000 O13 O 4.97100 -1.69300 3.16200 1.000 O14 O 3.73200 -3.59200 2.99700 1.000 N15 N 4.01600 -2.21200 -0.10600 1.000 S16 S 5.06500 -1.17700 -0.99600 1.000 C17 C 5.53300 0.01100 0.23000 1.000 O18 O 6.26500 -1.91400 -1.34700 1.000 O19 O 4.32000 -0.48000 -2.02700 1.000 C20 C 6.65300 -0.22700 1.00500 1.000 C21 C 7.02100 0.71000 1.97100 1.000 C22 C 6.26300 1.86700 2.14500 1.000 C23 C 5.13600 2.08900 1.35200 1.000 C24 C 4.76800 1.15200 0.38600 1.000 F25 F 6.61700 2.76700 3.07200 1.000 H26 H 0.00400 -0.00200 -0.01000 1.000 H27 H 1.90800 -1.01400 -1.19900 1.000 H28 H -0.08300 0.55400 3.62500 1.000 H29 H -0.78400 0.99000 2.07900 1.000 H30 H -1.90400 -1.26200 1.94100 1.000 H31 H -2.36900 -0.38000 3.40600 1.000 H32 H -1.19500 -1.70400 3.50200 1.000 H33 H 3.39500 -0.23500 4.90700 1.000 H34 H 2.29000 0.89000 4.07500 1.000 H35 H 0.56800 0.48200 5.87300 1.000 H36 H 1.68500 -0.66100 6.66400 1.000 H37 H 1.84400 2.24700 6.66200 1.000 H38 H 3.15600 1.19600 7.13900 1.000 H39 H 4.45200 -4.01800 3.50900 1.000 H40 H 4.47000 -3.01100 0.36300 1.000 H41 H 7.25100 -1.12500 0.87800 1.000 H42 H 7.89800 0.53700 2.58800 1.000 H43 H 4.54600 2.99000 1.48900 1.000 H44 H 3.88800 1.33500 -0.22500 1.000