# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CLS' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy S0 S -1.54900 0.77100 0.76600 1.000 C1 C -1.43700 0.72400 2.56100 1.000 C2 C -0.12200 0.21700 3.05100 1.000 C3 C -0.11000 -0.36100 4.44200 1.000 O4 O -1.42000 -0.19600 5.04700 1.000 C5 C -1.61800 -0.54900 6.32600 1.000 O6 O -0.68700 -0.91900 7.00200 1.000 C7 C -3.00200 -0.48300 6.92100 1.000 C8 C 1.03700 0.21200 2.40600 1.000 C9 C 2.25500 -0.29400 3.06400 1.000 O10 O 2.17400 -0.86800 4.28100 1.000 O11 O 3.33200 -0.19400 2.51000 1.000 N12 N 1.09100 0.69400 1.09100 1.000 C13 C 0.06800 1.52100 0.39600 1.000 C14 C 0.69400 1.13400 -0.93200 1.000 C15 C 1.79400 0.62400 -0.03100 1.000 O16 O 2.93200 0.27100 -0.25700 1.000 N17 N -0.02800 0.08700 -1.65900 1.000 C18 C 0.00300 0.05800 -3.00600 1.000 O19 O 0.63000 0.89800 -3.61600 1.000 C20 C -0.73900 -1.01800 -3.75400 1.000 C21 C -0.54300 -0.82700 -5.23600 1.000 C22 C 0.42500 -1.32800 -6.04100 1.000 C23 C 0.40400 -1.01900 -7.38800 1.000 C24 C -0.57900 -0.21500 -7.86200 1.000 S25 S -1.52300 0.12400 -6.38600 1.000 H26 H -2.23400 0.08900 2.94700 1.000 H27 H -1.57400 1.73300 2.94800 1.000 H28 H 0.63600 0.15500 5.04500 1.000 H29 H 0.13400 -1.42200 4.39200 1.000 H30 H -2.98200 -0.88900 7.93200 1.000 H31 H -3.33500 0.55300 6.95100 1.000 H32 H -3.68800 -1.06800 6.30800 1.000 H33 H 2.98000 -1.13400 4.74400 1.000 H34 H 0.11600 2.58700 0.62200 1.000 H35 H 0.98000 1.97800 -1.55900 1.000 H36 H -0.52900 -0.58400 -1.17100 1.000 H37 H -0.35600 -1.99500 -3.46000 1.000 H38 H -1.80100 -0.95800 -3.51700 1.000 H39 H 1.19800 -1.96500 -5.63700 1.000 H40 H 1.16100 -1.40800 -8.05200 1.000 H41 H -0.74800 0.12800 -8.87200 1.000