# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'FJA' 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 0.04100 2.43700 0.27800 1.000 C1 C -1.19600 1.83200 -0.36500 1.000 C2 C -1.48500 0.35700 -0.22900 1.000 C3 C -0.81200 -0.75200 0.07100 1.000 C4 C 0.47600 -0.70200 0.87300 1.000 C5 C 1.48500 -0.16900 -0.10900 1.000 C6 C 1.25000 0.83100 -1.21800 1.000 C7 C 1.34100 2.20700 -0.54900 1.000 C8 C -2.46800 2.41000 0.28100 1.000 C9 C -3.59000 1.48000 -0.18100 1.000 C10 C -2.93600 0.19500 -0.68000 1.000 C11 C 0.90300 -2.15000 1.18600 1.000 C12 C 2.38600 -2.09300 0.82400 1.000 C13 C 2.58100 -0.88100 -0.03800 1.000 C14 C 0.35300 -0.01300 2.22200 1.000 C15 C -3.59500 -1.02100 -0.02600 1.000 C16 C 0.15300 2.80100 1.70600 1.000 O17 O 2.46000 2.26600 0.33500 1.000 O18 O 0.12100 0.59300 -2.03300 1.000 O19 O -4.90600 -1.19900 -0.56400 1.000 C20 C 3.88800 -0.54800 -0.71100 1.000 C21 C 4.98000 -0.38500 0.34800 1.000 C22 C 4.27100 -1.67800 -1.66900 1.000 O23 O 0.21300 -3.09900 0.38500 1.000 C24 C -5.61200 -2.31500 -0.01700 1.000 H25 H -0.14200 3.53200 -0.13800 1.000 H26 H -1.22300 2.10900 -1.42400 1.000 H27 H -1.23300 -1.71500 -0.17100 1.000 H28 H 2.12800 0.77600 -1.92600 1.000 H29 H 1.41100 2.99200 -1.30100 1.000 H30 H -2.40000 2.39000 1.36500 1.000 H31 H -2.64100 3.42400 -0.07800 1.000 H32 H -4.26200 1.26200 0.64600 1.000 H33 H -4.14700 1.94900 -0.99500 1.000 H34 H -2.97300 0.12400 -1.76700 1.000 H35 H 0.77100 -2.35100 2.25000 1.000 H36 H 2.99400 -2.02100 1.72000 1.000 H37 H 2.65700 -2.98900 0.26000 1.000 H38 H 0.05200 -0.74100 2.97600 1.000 H39 H 1.31500 0.41900 2.49900 1.000 H40 H -0.39500 0.77700 2.16100 1.000 H41 H -2.99600 -1.91000 -0.22600 1.000 H42 H -3.66200 -0.86300 1.05000 1.000 H43 H 0.54900 1.95400 2.26700 1.000 H44 H 0.82500 3.65300 1.81200 1.000 H45 H -0.83100 3.06500 2.09200 1.000 H46 H 3.31200 2.11500 -0.09900 1.000 H47 H -0.00400 1.24800 -2.73400 1.000 H48 H 3.78200 0.38200 -1.27000 1.000 H49 H 5.92500 -0.14400 -0.13900 1.000 H50 H 4.70800 0.42000 1.03000 1.000 H51 H 5.08600 -1.31400 0.90700 1.000 H52 H 3.49300 -1.79400 -2.42300 1.000 H53 H 5.21600 -1.43700 -2.15600 1.000 H54 H 4.37700 -2.60800 -1.11000 1.000 H55 H 0.46200 -4.01700 0.56100 1.000 H56 H -6.59800 -2.38200 -0.47700 1.000 H57 H -5.05500 -3.23000 -0.21700 1.000 H58 H -5.72100 -2.18300 1.05900 1.000