# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9O2' 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 -1.05200 2.42200 0.14100 1.000 C1 C 0.35400 2.58700 0.05700 1.000 C2 C 1.16600 1.42700 0.04400 1.000 N3 N 0.57300 0.24400 0.11100 1.000 N4 N -1.55400 1.18100 0.20500 1.000 C5 C -7.66200 -1.07500 -0.96600 1.000 C6 C -6.97500 -2.17600 -0.15600 1.000 C7 C -5.48600 -1.94700 -0.16000 1.000 O8 O -5.02000 -0.99700 -0.75200 1.000 N9 N -4.67100 -2.79800 0.49500 1.000 C10 C -3.28300 -2.64200 0.41100 1.000 C11 C -2.73100 -1.37200 0.34300 1.000 C12 C -2.45700 -3.76000 0.40200 1.000 C13 C -1.08600 -3.61000 0.32000 1.000 C14 C -0.52800 -2.34900 0.24700 1.000 C15 C -1.34900 -1.22200 0.26100 1.000 C16 C -0.75100 0.13300 0.18900 1.000 C17 C -1.87700 3.55300 0.15000 1.000 C18 C -1.30800 4.80900 0.08200 1.000 N19 N -2.12400 5.93800 0.09100 1.000 C20 C 0.08200 4.96000 0.00600 1.000 C21 C 0.90200 3.87400 -0.01100 1.000 N22 N 2.53900 1.52700 -0.03700 1.000 C23 C 3.36200 0.31500 -0.04900 1.000 C24 C 4.83900 0.70200 -0.14400 1.000 C25 C 5.68500 -0.54500 -0.15700 1.000 C26 C 6.13600 -1.08600 1.03300 1.000 C27 C 6.91300 -2.22900 1.02100 1.000 C28 C 7.23800 -2.83200 -0.18000 1.000 C29 C 6.78500 -2.29200 -1.36900 1.000 C30 C 6.00500 -1.15100 -1.35700 1.000 H31 H -7.44300 -0.10500 -0.52000 1.000 H32 H -7.29500 -1.09500 -1.99200 1.000 H33 H -8.74000 -1.24100 -0.96300 1.000 H34 H -7.34300 -2.15600 0.87000 1.000 H35 H -7.19500 -3.14600 -0.60200 1.000 H36 H -5.04700 -3.51900 1.02300 1.000 H37 H -3.37100 -0.50200 0.35400 1.000 H38 H -2.88800 -4.74900 0.45900 1.000 H39 H -0.44800 -4.48200 0.31300 1.000 H40 H 0.54400 -2.23600 0.18300 1.000 H41 H -2.95000 3.44400 0.20800 1.000 H42 H -3.08800 5.83900 0.14400 1.000 H43 H -1.72900 6.82200 0.04400 1.000 H44 H 0.50800 5.95100 -0.04600 1.000 H45 H 1.97300 4.00400 -0.07000 1.000 H46 H 2.96000 2.39900 -0.08600 1.000 H47 H 3.19200 -0.24900 0.86800 1.000 H48 H 3.09100 -0.29900 -0.90800 1.000 H49 H 5.00800 1.26600 -1.06200 1.000 H50 H 5.10900 1.31600 0.71500 1.000 H51 H 5.88300 -0.61400 1.97100 1.000 H52 H 7.26600 -2.65100 1.95000 1.000 H53 H 7.84500 -3.72500 -0.18900 1.000 H54 H 7.03900 -2.76300 -2.30700 1.000 H55 H 5.64900 -0.73000 -2.28600 1.000