# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J19' 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 2.07200 -0.53600 -0.72700 1.000 O1 O 0.16100 4.16200 -0.05400 1.000 C2 C -0.24400 3.01800 0.04700 1.000 N3 N -1.52800 2.73000 0.17300 1.000 C4 C 0.65900 1.86200 0.03200 1.000 S5 S -0.41200 0.45900 0.20700 1.000 C6 C -1.90100 1.41800 0.28100 1.000 N7 N -3.12400 0.95900 0.41400 1.000 C8 C -3.34200 -0.38900 0.51100 1.000 C9 C -2.47700 -1.18800 1.26200 1.000 C10 C -2.70300 -2.54600 1.35500 1.000 C11 C -4.43500 -0.97200 -0.13700 1.000 Cl12 Cl -5.52100 0.01100 -1.06800 1.000 C13 C -4.64900 -2.33200 -0.03500 1.000 C14 C -3.78300 -3.11700 0.70700 1.000 C15 C 2.01100 1.86600 -0.08900 1.000 C16 C 2.73700 0.59900 -0.24700 1.000 C17 C 2.75500 -1.72400 -0.86900 1.000 C18 C 4.10200 -1.79900 -0.54200 1.000 O19 O 4.76900 -2.97400 -0.68500 1.000 C20 C 4.77300 -0.67200 -0.06900 1.000 C21 C 4.09600 0.52300 0.08200 1.000 O22 O 6.09200 -0.75000 0.24900 1.000 C23 C 6.71600 0.44400 0.72800 1.000 H24 H 1.02400 -0.48100 -0.98200 1.000 H25 H -1.63300 -0.74300 1.76800 1.000 H26 H -2.03400 -3.16400 1.93600 1.000 H27 H -5.49200 -2.78400 -0.53400 1.000 H28 H -3.95400 -4.18100 0.78300 1.000 H29 H 2.55200 2.80000 -0.06900 1.000 H30 H 2.24000 -2.60100 -1.23400 1.000 H31 H 5.17500 -3.09200 -1.55400 1.000 H32 H 4.61400 1.39600 0.44800 1.000 H33 H 6.64400 1.22100 -0.03300 1.000 H34 H 6.21400 0.77600 1.63700 1.000 H35 H 7.76500 0.24400 0.94400 1.000 H36 H -2.19400 3.43500 0.18900 1.000