# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0O5' 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 1.95400 -1.70400 -1.50400 1.000 C1 C 1.64400 -0.72800 -0.84800 1.000 N2 N 2.60000 0.05000 -0.30400 1.000 C3 C 4.01400 -0.28000 -0.50300 1.000 C4 C 4.88500 0.75400 0.21300 1.000 N5 N 6.30200 0.42400 0.01300 1.000 C6 C 7.16800 1.51600 0.48000 1.000 C7 C 8.63000 1.15600 0.19800 1.000 O8 O 8.93900 -0.08900 0.83000 1.000 C9 C 8.11500 -1.17400 0.39800 1.000 C10 C 6.64800 -0.83900 0.68100 1.000 C11 C 0.21800 -0.39300 -0.65100 1.000 C12 C -0.13800 0.73100 0.09800 1.000 C13 C -1.46700 1.04300 0.28100 1.000 C14 C -0.77400 -1.19600 -1.22000 1.000 C15 C -2.10200 -0.88200 -1.03600 1.000 C16 C -2.45700 0.23700 -0.28200 1.000 C17 C -3.88600 0.57300 -0.08500 1.000 N18 N -4.30000 1.82100 -0.22500 1.000 C19 C -5.56400 2.17600 -0.06100 1.000 C20 C -5.94500 3.62200 -0.24100 1.000 C21 C -4.81400 -0.44000 0.24900 1.000 C22 C -4.43200 -1.77800 0.40400 1.000 C23 C -5.37000 -2.71200 0.72700 1.000 C24 C -6.70600 -2.35700 0.90500 1.000 C25 C -7.11400 -1.06500 0.76100 1.000 C26 C -6.17400 -0.07800 0.43000 1.000 C27 C -6.53200 1.27300 0.26700 1.000 H28 H 2.35300 0.82800 0.22000 1.000 H29 H 4.21700 -1.27000 -0.09700 1.000 H30 H 4.24200 -0.27100 -1.56900 1.000 H31 H 4.68100 1.74500 -0.19400 1.000 H32 H 4.65700 0.74600 1.27900 1.000 H33 H 6.91200 2.43500 -0.04700 1.000 H34 H 7.02900 1.65800 1.55100 1.000 H35 H 8.78200 1.06600 -0.87700 1.000 H36 H 9.27900 1.93700 0.59400 1.000 H37 H 8.25200 -1.33200 -0.67200 1.000 H38 H 8.39200 -2.08000 0.93800 1.000 H39 H 6.50000 -0.73400 1.75600 1.000 H40 H 6.01200 -1.63800 0.30200 1.000 H41 H 0.62800 1.35500 0.53500 1.000 H42 H -1.74200 1.91200 0.86000 1.000 H43 H -0.49900 -2.06200 -1.80300 1.000 H44 H -2.86800 -1.50300 -1.47600 1.000 H45 H -6.21500 3.80000 -1.28200 1.000 H46 H -6.79500 3.85700 0.40000 1.000 H47 H -5.10100 4.25700 0.02900 1.000 H48 H -3.40000 -2.06800 0.26900 1.000 H49 H -5.07400 -3.74300 0.84700 1.000 H50 H -7.42900 -3.11800 1.16000 1.000 H51 H -8.15200 -0.80300 0.90100 1.000 H52 H -7.55700 1.58900 0.39600 1.000