# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0XU' 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 6.37100 -0.47100 -1.91200 1.000 C1 C 5.95200 0.50000 -0.89200 1.000 C2 C 7.16500 1.02100 -0.16700 1.000 O3 O 8.20000 0.39800 -0.19300 1.000 O4 O 7.09600 2.17900 0.50900 1.000 C5 C 5.01500 -0.18300 0.10600 1.000 C6 C 3.72800 -0.60300 -0.60700 1.000 C7 C 2.79100 -1.28500 0.39200 1.000 N8 N 3.40200 -2.53700 0.86000 1.000 C9 C 1.47600 -1.58800 -0.27900 1.000 C10 C 0.36800 -1.02600 0.16000 1.000 O11 O -0.89000 -1.30300 -0.28200 1.000 C12 C 0.28300 0.03200 1.24300 1.000 O13 O 1.06100 1.17700 0.88800 1.000 C14 C -1.22300 0.39400 1.29800 1.000 O15 O -1.40900 1.80600 1.41500 1.000 C16 C -1.70200 -0.12600 -0.08600 1.000 N17 N -3.12400 -0.47700 -0.04300 1.000 C18 C -3.64500 -1.69300 0.28600 1.000 N19 N -4.94400 -1.65200 0.22100 1.000 C20 C -5.33800 -0.41100 -0.15300 1.000 C21 C -6.58100 0.20500 -0.38000 1.000 N22 N -7.76000 -0.50200 -0.22400 1.000 N23 N -6.59600 1.48200 -0.74800 1.000 C24 C -5.47600 2.16400 -0.89900 1.000 N25 N -4.29000 1.62900 -0.69700 1.000 C26 C -4.17500 0.35900 -0.32100 1.000 H27 H 6.85700 -1.24900 -1.49300 1.000 H28 H 5.58200 -0.78800 -2.45600 1.000 H29 H 5.43100 1.32800 -1.37200 1.000 H30 H 7.90100 2.47300 0.95900 1.000 H31 H 5.50500 -1.06400 0.52000 1.000 H32 H 4.77500 0.51100 0.91200 1.000 H33 H 3.23800 0.27900 -1.02000 1.000 H34 H 3.96800 -1.29600 -1.41200 1.000 H35 H 2.62200 -0.62400 1.24200 1.000 H36 H 3.65300 -3.12900 0.08300 1.000 H37 H 4.20100 -2.35200 1.44700 1.000 H38 H 1.44200 -2.26600 -1.11900 1.000 H39 H 0.61300 -0.37400 2.20000 1.000 H40 H 2.01200 1.00800 0.84500 1.000 H41 H -1.72500 -0.13500 2.10900 1.000 H42 H -1.02900 2.18800 2.21700 1.000 H43 H -1.50800 0.61100 -0.86500 1.000 H44 H -3.06500 -2.56200 0.56000 1.000 H45 H -7.73500 -1.43300 0.04500 1.000 H46 H -8.61200 -0.06600 -0.38400 1.000 H47 H -5.53500 3.20000 -1.20000 1.000