# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'RIE' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N -0.44600 0.93800 0.19300 1.000 C1 C 0.16100 -0.19700 0.62700 1.000 C2 C -0.73200 -1.20500 0.48700 1.000 C3 C -0.52800 -2.65800 0.83200 1.000 C4 C 1.56500 -0.31300 1.16300 1.000 C5 C 2.54400 -0.46900 -0.00200 1.000 C6 C 4.95100 -0.73400 -0.61500 1.000 C7 C -1.54900 -3.07900 1.89100 1.000 C8 C 1.43700 3.91700 1.24900 1.000 C9 C -7.84200 -0.53200 -0.84600 1.000 C10 C -8.84300 0.05000 -0.09000 1.000 C11 C 0.04900 3.00000 -0.96700 1.000 C12 C 0.63500 4.25000 -0.98800 1.000 C13 C -6.27600 -0.13000 0.91900 1.000 O14 O -3.26600 -2.49300 -0.20700 1.000 C15 C -3.16000 -1.29600 -0.38600 1.000 N16 N -4.19600 -0.59500 -0.88900 1.000 C17 C -5.47000 -1.26500 -1.16100 1.000 C18 C -5.80800 -1.13400 -2.64800 1.000 C19 C -6.55900 -0.62400 -0.34000 1.000 C20 C -7.27800 0.44700 1.67700 1.000 C21 C -8.56100 0.54000 1.17100 1.000 C22 C -4.04700 0.83600 -1.16400 1.000 C23 C -1.89700 -0.60800 -0.05100 1.000 C24 C -0.71500 -3.51100 -0.42400 1.000 C25 C 0.14800 2.20700 0.16900 1.000 C26 C 0.84900 2.66800 1.27600 1.000 C27 C 1.32900 4.71000 0.11900 1.000 F28 F 1.90000 5.93400 0.09600 1.000 N29 N -1.64200 0.67800 -0.19700 1.000 C30 C 3.95400 -0.70200 0.54400 1.000 O31 O 3.99400 -1.94900 1.24100 1.000 C32 C 6.37400 -0.84200 -0.06200 1.000 O33 O 6.53000 -2.09600 0.60600 1.000 C34 C 7.37700 -0.74900 -1.21300 1.000 C35 C 8.77800 -0.73200 -0.65700 1.000 O36 O 8.95500 -0.78900 0.53600 1.000 O37 O 9.82900 -0.65400 -1.48900 1.000 H38 H 0.48000 -2.80100 1.22200 1.000 H39 H 1.81300 0.58500 1.72800 1.000 H40 H 1.63400 -1.18400 1.81500 1.000 H41 H 2.24600 -1.32000 -0.61500 1.000 H42 H 2.53400 0.43700 -0.60900 1.000 H43 H 4.74200 -1.59500 -1.25100 1.000 H44 H 4.85800 0.18100 -1.20100 1.000 H45 H -2.54900 -2.79000 1.56700 1.000 H46 H -1.50900 -4.16000 2.02400 1.000 H47 H -1.31700 -2.58700 2.83500 1.000 H48 H 1.97800 4.27700 2.11100 1.000 H49 H -8.06400 -0.91800 -1.83000 1.000 H50 H -9.84500 0.12300 -0.48600 1.000 H51 H -0.49200 2.64200 -1.83000 1.000 H52 H 0.55800 4.86700 -1.87100 1.000 H53 H -5.27300 -0.20300 1.31500 1.000 H54 H -5.38900 -2.31900 -0.89800 1.000 H55 H -5.02000 -1.59700 -3.24100 1.000 H56 H -6.75600 -1.63200 -2.85000 1.000 H57 H -5.88900 -0.07900 -2.91000 1.000 H58 H -7.05600 0.83300 2.66100 1.000 H59 H -9.34200 0.99500 1.76100 1.000 H60 H -3.59600 0.97200 -2.14700 1.000 H61 H -5.02700 1.31400 -1.14500 1.000 H62 H -3.40800 1.28800 -0.40600 1.000 H63 H 0.10900 -3.32800 -1.11400 1.000 H64 H -0.73000 -4.56500 -0.14800 1.000 H65 H -1.65700 -3.24800 -0.90600 1.000 H66 H 0.93300 2.05000 2.15800 1.000 H67 H 4.21700 0.10500 1.22700 1.000 H68 H 3.77000 -2.71400 0.69300 1.000 H69 H 6.55200 -0.03000 0.64300 1.000 H70 H 6.38600 -2.86500 0.03800 1.000 H71 H 7.25800 -1.61000 -1.87000 1.000 H72 H 7.19900 0.16700 -1.77700 1.000 H73 H 10.70800 -0.64600 -1.08600 1.000