# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C0S' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N 0.66700 -2.05100 -0.37600 1.000 C1 C -5.13300 0.45200 0.14700 1.000 N2 N -2.64700 0.58600 0.01000 1.000 C3 C -3.75500 -0.09900 0.11500 1.000 C4 C -7.50500 0.11300 0.28200 1.000 C5 C -1.22700 -2.65400 0.16300 1.000 C6 C -2.10300 -1.42800 0.12300 1.000 C7 C -7.70300 1.48000 0.19700 1.000 C8 C -6.62100 2.33500 0.08700 1.000 C9 C -5.33800 1.82800 0.06200 1.000 C10 C -6.22600 -0.40400 0.25800 1.000 N11 N -3.41100 -1.40500 0.18800 1.000 O12 O -1.69200 -0.16100 0.01300 1.000 C13 C -0.35700 -2.83500 -1.09300 1.000 C14 C 0.09400 -2.44600 0.92600 1.000 C15 C 1.71000 -1.28700 -0.75600 1.000 O16 O 1.95600 -1.13900 -1.93700 1.000 H17 H -8.35400 -0.54900 0.36800 1.000 H18 H -1.76800 -3.55300 0.45600 1.000 H19 H -8.70500 1.88100 0.21700 1.000 H20 H -6.78100 3.40100 0.02100 1.000 H21 H -4.49300 2.49600 -0.02400 1.000 H22 H -6.07300 -1.47100 0.32400 1.000 H23 H -0.75300 -2.33600 -1.97800 1.000 H24 H -0.06700 -3.86900 -1.28100 1.000 H25 H 0.51700 -3.36500 1.33100 1.000 H26 H 0.05800 -1.63500 1.65400 1.000 O27 O 2.47800 -0.68600 0.17200 1.000 C28 C 3.58400 0.12200 -0.31000 1.000 C29 C 3.11100 1.56300 -0.51400 1.000 C30 C 4.71800 0.09900 0.71700 1.000 F31 F 5.15000 -1.21900 0.90400 1.000 F32 F 5.78300 0.87700 0.25200 1.000 F33 F 4.25800 0.61600 1.93300 1.000 F34 F 2.65100 2.08000 0.70100 1.000 F35 F 4.17600 2.34200 -0.97900 1.000 F36 F 2.07400 1.58400 -1.45300 1.000 H37 H 3.94200 -0.28100 -1.25700 1.000