# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9E7' 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 -4.21300 -0.09400 0.13000 1.000 S1 S 5.21400 0.77500 0.31400 1.000 N2 N -2.78100 1.75100 -0.54000 1.000 C3 C -2.91300 0.28800 -0.53000 1.000 C4 C -1.74600 -0.32400 0.24700 1.000 C5 C -0.43700 -0.04100 -0.49200 1.000 C6 C 0.73000 -0.65400 0.28600 1.000 C7 C 2.04000 -0.37100 -0.45300 1.000 N8 N 3.16000 -0.95900 0.29300 1.000 O9 O -4.77700 0.69200 0.85400 1.000 C10 C 4.43700 -0.70600 -0.38800 1.000 O11 O -4.74600 -1.30600 -0.09000 1.000 H12 H 6.35300 0.88300 -0.39300 1.000 H13 H -3.50400 2.17600 -1.10100 1.000 H14 H -2.78800 2.12100 0.39900 1.000 H15 H -2.90300 -0.08400 -1.55500 1.000 H16 H -1.70400 0.11500 1.24400 1.000 H17 H -1.89100 -1.40100 0.33000 1.000 H18 H -0.48000 -0.48000 -1.48800 1.000 H19 H -0.29200 1.03600 -0.57500 1.000 H20 H 0.77300 -0.21500 1.28300 1.000 H21 H 0.58500 -1.73100 0.36900 1.000 H22 H 1.99700 -0.81000 -1.45000 1.000 H23 H 2.18400 0.70600 -0.53600 1.000 H24 H 3.01700 -1.94700 0.44000 1.000 H25 H 4.25700 -0.55300 -1.45200 1.000 H26 H 5.09700 -1.56200 -0.25100 1.000 H27 H -5.58100 -1.50600 0.35600 1.000