# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0I5' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O -6.78600 -1.67600 1.70500 1.000 C1 C -6.42200 -2.45200 0.56100 1.000 C2 C -5.88000 -1.52000 -0.52900 1.000 N3 N -4.82000 -0.68600 0.05900 1.000 C4 C -5.11400 0.02400 1.31400 1.000 C5 C -5.69400 -0.98300 2.31400 1.000 C6 C -3.61500 -0.57500 -0.53500 1.000 O7 O -3.35800 -1.24200 -1.51800 1.000 N8 N -2.69500 0.27500 -0.03800 1.000 C9 C -1.42700 0.47700 -0.74400 1.000 C10 C -0.35300 0.84600 0.24700 1.000 O11 O -0.65800 1.26600 1.34300 1.000 C12 C -1.58600 1.60400 -1.76600 1.000 C13 C -0.30500 1.72700 -2.59400 1.000 C14 C -0.13100 0.47300 -3.45300 1.000 C15 C -0.39900 2.95700 -3.49900 1.000 N16 N 0.94600 0.70800 -0.08500 1.000 C17 C 1.98800 0.96500 0.91200 1.000 C18 C 2.30100 2.43900 0.94300 1.000 O19 O 1.92900 3.15400 0.04400 1.000 C20 C 3.25000 0.18300 0.54400 1.000 C21 C 2.96500 -1.31700 0.63400 1.000 C22 C 4.20900 -2.08700 0.27100 1.000 C23 C 5.11700 -2.43600 1.25300 1.000 C24 C 4.43800 -2.45000 -1.04300 1.000 C25 C 6.25800 -3.14200 0.92100 1.000 C26 C 5.57900 -3.15700 -1.37500 1.000 C27 C 6.49000 -3.50100 -0.39400 1.000 C28 C 3.07900 3.02000 2.09600 1.000 H29 H -5.65400 -3.17200 0.83900 1.000 H30 H -7.29900 -2.98000 0.18500 1.000 H31 H -5.47000 -2.11200 -1.34700 1.000 H32 H -6.68300 -0.88400 -0.90200 1.000 H33 H -4.19700 0.45400 1.71600 1.000 H34 H -5.84000 0.81500 1.12700 1.000 H35 H -6.04600 -0.45500 3.20000 1.000 H36 H -4.92200 -1.69900 2.59900 1.000 H37 H -2.87200 0.75400 0.78700 1.000 H38 H -1.14700 -0.44300 -1.25800 1.000 H39 H -2.42500 1.38000 -2.42600 1.000 H40 H -1.77400 2.54300 -1.24600 1.000 H41 H 0.55000 1.83200 -1.92600 1.000 H42 H 0.81800 0.52700 -3.98600 1.000 H43 H -0.13800 -0.41000 -2.81400 1.000 H44 H -0.94800 0.40900 -4.17200 1.000 H45 H -0.52300 3.85000 -2.88700 1.000 H46 H 0.51400 3.04500 -4.08800 1.000 H47 H -1.25400 2.85200 -4.16700 1.000 H48 H 1.19100 0.43900 -0.98400 1.000 H49 H 1.63700 0.64800 1.89400 1.000 H50 H 3.55000 0.43600 -0.47300 1.000 H51 H 4.05300 0.44300 1.23500 1.000 H52 H 2.66500 -1.57000 1.65100 1.000 H53 H 2.16300 -1.57700 -0.05600 1.000 H54 H 4.93600 -2.15600 2.28100 1.000 H55 H 3.72700 -2.18200 -1.80900 1.000 H56 H 6.96800 -3.41400 1.68800 1.000 H57 H 5.75800 -3.44100 -2.40200 1.000 H58 H 7.38100 -4.05200 -0.65400 1.000 F59 F 3.24300 4.39600 1.90100 1.000 H60 H 2.53500 2.84700 3.02500 1.000 H61 H 4.05600 2.54200 2.15200 1.000