# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9J7' 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 2.99900 -0.36300 0.41300 1.000 C1 C 4.22000 0.19800 0.74400 1.000 C2 C 2.92100 -1.70200 0.07900 1.000 C3 C 1.75300 0.48500 0.42300 1.000 C4 C 5.36500 -0.58400 0.74000 1.000 C5 C 5.28400 -1.92400 0.40500 1.000 C6 C 4.06200 -2.48200 0.07500 1.000 C7 C -4.76000 -2.65700 -0.28900 1.000 C8 C -5.25900 -1.29000 -0.76200 1.000 C9 C -1.07500 1.55900 -0.75800 1.000 C10 C -1.76500 0.87000 -1.74800 1.000 C11 C -1.60400 1.64600 0.52300 1.000 C12 C -2.81400 1.04800 0.81200 1.000 C13 C -3.50300 0.36000 -0.17800 1.000 C14 C -3.39000 1.14000 2.20100 1.000 C15 C -2.97500 0.27200 -1.45900 1.000 C16 C 6.52700 -2.77600 0.40000 1.000 C17 C -4.91600 1.20800 2.11900 1.000 C18 C -5.42900 0.12500 1.20800 1.000 C19 C -5.31100 -3.74800 -1.21000 1.000 F20 F 6.55800 -0.03900 1.06200 1.000 F21 F 4.29600 1.50700 1.07000 1.000 N22 N -4.73100 -0.24600 0.11900 1.000 N23 N 0.15400 2.15900 -1.05100 1.000 O24 O 2.54600 2.16100 -1.49500 1.000 O25 O -6.48300 -0.41900 1.45900 1.000 O26 O 1.14500 0.23500 -2.16200 1.000 S27 S 1.51300 1.22700 -1.21400 1.000 H28 H 1.96800 -2.13900 -0.17900 1.000 H29 H 0.89200 -0.13700 0.67000 1.000 H30 H 1.85600 1.27400 1.16800 1.000 H31 H 4.00000 -3.52800 -0.18700 1.000 H32 H -3.67000 -2.67500 -0.31700 1.000 H33 H -5.10100 -2.83600 0.73000 1.000 H34 H -4.91800 -1.11200 -1.78200 1.000 H35 H -6.34900 -1.27200 -0.73500 1.000 H36 H -1.35400 0.80200 -2.74500 1.000 H37 H -1.06800 2.18100 1.29300 1.000 H38 H -3.09700 0.26100 2.77500 1.000 H39 H -3.01300 2.03700 2.69200 1.000 H40 H -3.51100 -0.26300 -2.22800 1.000 H41 H 6.66800 -3.21900 1.38600 1.000 H42 H 6.42200 -3.56800 -0.34200 1.000 H43 H 7.39000 -2.15800 0.15300 1.000 H44 H -5.33800 1.07400 3.11400 1.000 H45 H -5.21400 2.18100 1.72800 1.000 H46 H -6.40100 -3.73000 -1.18300 1.000 H47 H -4.97000 -3.56900 -2.23000 1.000 H48 H -4.95500 -4.72100 -0.87300 1.000 H49 H 0.21000 3.12200 -1.15700 1.000