# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9SU' 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 2.26600 -0.70500 -0.24500 1.000 C1 C 3.56200 0.04800 -0.06700 1.000 C2 C 3.81500 1.33700 0.36300 1.000 C3 C 5.11700 1.80100 0.44100 1.000 C4 C 6.16500 0.97100 0.08800 1.000 C5 C -5.87300 0.33600 0.63500 1.000 C6 C -4.43100 -0.01700 0.38900 1.000 C7 C -3.73000 -0.69800 1.40800 1.000 C8 C -1.84100 -0.70900 0.02800 1.000 C9 C 0.26200 -1.65700 0.89900 1.000 C10 C 1.53900 -0.83100 1.09100 1.000 C11 C 5.91700 -0.31500 -0.34300 1.000 C12 C 4.60700 -0.79100 -0.42500 1.000 C13 C 2.68200 -2.09100 -0.75500 1.000 C14 C 1.38200 -0.00700 -1.27400 1.000 C15 C 0.10300 -0.82500 -1.48400 1.000 C16 C -3.78100 0.28800 -0.76300 1.000 C17 C -4.44000 1.03000 -1.89600 1.000 C18 C -5.96000 0.97700 -1.76100 1.000 C19 C -6.33500 1.41700 -0.34100 1.000 N20 N -2.44100 -1.03300 1.20600 1.000 N21 N -0.53200 -1.05300 -0.17900 1.000 N22 N 4.14500 -2.04500 -0.83200 1.000 N23 N -2.50000 -0.07000 -0.91400 1.000 O24 O -4.28500 -0.97900 2.45700 1.000 Cl25 Cl 2.49800 2.37700 0.80600 1.000 H26 H 5.31300 2.80800 0.77700 1.000 H27 H 7.18100 1.33200 0.14900 1.000 H28 H -6.48800 -0.55400 0.50400 1.000 H29 H -5.98400 0.70300 1.65500 1.000 H30 H 0.52600 -2.68000 0.63100 1.000 H31 H -0.31500 -1.65900 1.82400 1.000 H32 H 2.18800 -1.32700 1.81300 1.000 H33 H 1.27800 0.16200 1.45900 1.000 H34 H 6.74000 -0.95700 -0.61800 1.000 H35 H 2.36400 -2.86300 -0.05400 1.000 H36 H 1.12100 0.98900 -0.91400 1.000 H37 H 1.91900 0.07800 -2.21800 1.000 H38 H -0.58000 -0.27600 -2.13200 1.000 H39 H 0.35300 -1.78200 -1.94400 1.000 H40 H -4.11400 2.07000 -1.88200 1.000 H41 H -4.14700 0.57500 -2.84200 1.000 H42 H -6.41700 1.65000 -2.48700 1.000 H43 H -6.30900 -0.04100 -1.93500 1.000 H44 H -7.41600 1.54000 -0.26800 1.000 H45 H -5.84100 2.36000 -0.10600 1.000 H46 H -1.94400 -1.50100 1.89500 1.000 H47 H 2.25600 -2.27400 -1.74100 1.000 H48 H 4.71000 -2.77800 -1.12200 1.000