# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J4V' 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 -5.73100 0.51300 1.34600 1.000 C1 C -5.75100 0.23100 -0.15800 1.000 C2 C -6.67100 1.23600 -0.85300 1.000 C3 C -6.15600 2.65500 -0.60700 1.000 C4 C -4.73900 2.78800 -1.16800 1.000 C5 C -6.13600 2.93700 0.89700 1.000 C6 C -5.21600 1.93200 1.59300 1.000 C7 C -3.79900 2.06500 1.03100 1.000 C8 C -3.81800 1.78300 -0.47300 1.000 C9 C -4.33400 0.36400 -0.72000 1.000 C10 C -3.42700 -0.62600 -0.03500 1.000 O11 O -3.87000 -1.36500 0.81900 1.000 N12 N -2.12300 -0.69000 -0.37100 1.000 C13 C -1.24200 -1.65200 0.29500 1.000 C14 C -1.33800 -2.98600 -0.40000 1.000 O15 O -2.07000 -3.11900 -1.35700 1.000 N16 N -0.60900 -4.03000 0.04200 1.000 O17 O -0.69900 -5.28300 -0.61100 1.000 C18 C 0.18000 -1.15600 0.23500 1.000 C19 C 1.00900 -1.30600 1.33300 1.000 C20 C 2.31200 -0.85300 1.28400 1.000 C21 C 0.65300 -0.55700 -0.91800 1.000 C22 C 1.95400 -0.10000 -0.97800 1.000 C23 C 2.79200 -0.24300 0.12600 1.000 C24 C 4.19100 0.24600 0.06800 1.000 C25 C 4.67000 0.85500 -1.09000 1.000 C26 C 5.97400 1.30900 -1.14100 1.000 F27 F 6.44000 1.90000 -2.26300 1.000 C28 C 6.80600 1.16000 -0.04100 1.000 F29 F 8.08000 1.60500 -0.09400 1.000 C30 C 6.33300 0.55400 1.11300 1.000 F31 F 7.14600 0.41000 2.18200 1.000 C32 C 5.02800 0.10200 1.17300 1.000 H33 H -6.74100 0.41800 1.74600 1.000 H34 H -5.07500 -0.20300 1.84100 1.000 H35 H -6.11800 -0.78000 -0.33300 1.000 H36 H -6.68500 1.03600 -1.92400 1.000 H37 H -7.68100 1.14100 -0.45300 1.000 H38 H -6.81200 3.37100 -1.10200 1.000 H39 H -4.75200 2.58800 -2.24000 1.000 H40 H -4.37200 3.79900 -0.99300 1.000 H41 H -5.76900 3.94800 1.07300 1.000 H42 H -7.14600 2.84200 1.29800 1.000 H43 H -5.20200 2.13300 2.66400 1.000 H44 H -3.43200 3.07600 1.20600 1.000 H45 H -3.14300 1.34900 1.52600 1.000 H46 H -2.80900 1.87800 -0.87300 1.000 H47 H -4.34700 0.16300 -1.79100 1.000 H48 H -1.76900 -0.09900 -1.05300 1.000 H49 H -1.54500 -1.76300 1.33600 1.000 H50 H -0.02300 -3.92300 0.80800 1.000 H51 H -0.14100 -5.97000 -0.22300 1.000 H52 H 0.63600 -1.77800 2.22900 1.000 H53 H 2.95800 -0.97000 2.14100 1.000 H54 H 0.00300 -0.44700 -1.77400 1.000 H55 H 2.32200 0.36700 -1.88000 1.000 H56 H 4.02300 0.97100 -1.94700 1.000 H57 H 4.65800 -0.36500 2.07400 1.000