# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J2I' 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 6.92700 3.15000 0.16100 1.000 C1 C 6.90000 1.75700 0.09800 1.000 C2 C -6.68800 -0.33200 1.21100 1.000 C3 C -6.50200 0.01200 -1.15900 1.000 C4 C 3.63300 -2.44800 0.06200 1.000 C5 C 5.64600 3.59700 0.07400 1.000 C6 C -4.53700 -0.39800 0.15300 1.000 C7 C -7.28200 -0.07600 -0.01600 1.000 C8 C -5.31600 -0.49300 1.29400 1.000 C9 C -5.13000 -0.15500 -1.07400 1.000 C10 C 5.57300 1.38800 -0.02800 1.000 C11 C 3.38400 -3.82200 0.00400 1.000 C12 C 4.97000 -2.25900 -0.11300 1.000 C13 C 4.91200 0.14300 -0.13700 1.000 C14 C 2.87200 1.24200 -0.25900 1.000 C15 C -2.38800 0.75700 0.47600 1.000 C16 C 0.65400 2.35600 -0.28000 1.000 C17 C 0.84300 -0.14500 -0.60700 1.000 C18 C -0.39600 2.13800 0.81700 1.000 C19 C -0.21300 -0.36500 0.49300 1.000 C20 C 2.03400 -4.47900 0.14400 1.000 C21 C -9.17300 0.34700 -1.39300 1.000 C22 C -3.04300 -0.58000 0.24400 1.000 N23 N 5.53800 -3.48300 -0.27100 1.000 N24 N 3.59500 0.11800 -0.24800 1.000 N25 N 3.42700 2.42800 -0.17000 1.000 N26 N 4.51900 -4.44100 -0.19300 1.000 N27 N 4.81900 2.54300 -0.04700 1.000 N28 N 1.49200 1.15300 -0.37900 1.000 N29 N -1.04800 0.84000 0.59100 1.000 N30 N 5.63400 -1.03400 -0.12900 1.000 O31 O -3.06700 1.75900 0.55900 1.000 O32 O -8.62900 0.08700 -0.09800 1.000 F33 F -4.73600 -0.74200 2.48900 1.000 F34 F -4.36900 -0.06300 -2.18600 1.000 H35 H 7.80900 3.76500 0.26500 1.000 H36 H 7.75200 1.09400 0.14000 1.000 H37 H -7.29500 -0.40100 2.10200 1.000 H38 H -6.96300 0.21000 -2.11500 1.000 H39 H 2.89600 -1.67400 0.21500 1.000 H40 H 5.34000 4.63300 0.09800 1.000 H41 H 0.15500 2.53500 -1.23200 1.000 H42 H 1.27500 3.21500 -0.02500 1.000 H43 H 1.58600 -0.94100 -0.56500 1.000 H44 H 0.35900 -0.14700 -1.58400 1.000 H45 H 0.09000 2.13800 1.79300 1.000 H46 H -1.14000 2.93300 0.77600 1.000 H47 H -0.83600 -1.22100 0.23600 1.000 H48 H 0.28400 -0.54400 1.44700 1.000 H49 H 1.57000 -4.56900 -0.83800 1.000 H50 H 2.15700 -5.47000 0.58100 1.000 H51 H 1.40100 -3.87200 0.79100 1.000 H52 H -10.25500 0.45700 -1.31800 1.000 H53 H -8.74200 1.26600 -1.79100 1.000 H54 H -8.93800 -0.48200 -2.06000 1.000 H55 H -2.80900 -1.24800 1.07300 1.000 H56 H -2.67200 -1.01000 -0.68600 1.000 H57 H 6.60400 -1.00800 -0.13400 1.000 H58 H 6.48000 -3.66100 -0.41500 1.000