# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C7R' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy P0 P 3.88600 -0.56000 -0.29700 1.000 C1 C 1.76000 0.91600 0.36600 1.000 O2 O 2.53600 0.25000 -0.63200 1.000 C3 C 0.54900 1.58300 -0.29000 1.000 O4 O -0.38000 0.58800 -0.77200 1.000 C5 C -0.27300 2.37400 0.75900 1.000 O6 O 0.24300 3.69600 0.92000 1.000 C7 C -1.68000 2.40400 0.11200 1.000 C8 C -1.65900 1.23200 -0.89400 1.000 N9 N -2.72800 0.28200 -0.57700 1.000 C10 C -2.70400 -0.38700 0.59000 1.000 O11 O -1.79000 -0.19500 1.37400 1.000 N12 N -3.66400 -1.25600 0.90400 1.000 C13 C -4.67000 -1.48400 0.07000 1.000 N14 N -5.65500 -2.38400 0.40500 1.000 C15 C -4.72400 -0.80000 -1.16100 1.000 C16 C -3.74400 0.08500 -1.46400 1.000 O17 O 4.82900 0.32700 0.41900 1.000 S18 S 3.42400 -2.23100 0.92200 1.000 O19 O 4.56200 -1.06700 -1.66800 1.000 H20 H 1.42000 0.19100 1.10500 1.000 H21 H 2.37200 1.67500 0.85500 1.000 H22 H 0.86600 2.23700 -1.10200 1.000 H23 H -0.29600 1.84700 1.71300 1.000 H24 H -0.23900 4.23000 1.56600 1.000 H25 H -2.45000 2.24700 0.86700 1.000 H26 H -1.84100 3.35000 -0.40600 1.000 H27 H -1.78700 1.61300 -1.90700 1.000 H28 H -5.61600 -2.85300 1.25300 1.000 H29 H -6.39000 -2.54900 -0.20700 1.000 H30 H -5.53600 -0.97400 -1.85100 1.000 H31 H -3.76600 0.62500 -2.39800 1.000 H32 H 2.57300 -2.93800 0.15700 1.000 H33 H 5.38200 -1.56400 -1.54200 1.000