# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'URI' 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 -0.24100 0.42900 -1.02900 1.000 C1 C 0.48200 -0.63400 -1.42200 1.000 N2 N 0.74300 -0.85000 -2.72500 1.000 C3 C 0.28900 0.00700 -3.66100 1.000 C4 C -0.46800 1.13400 -3.26000 1.000 C5 C -0.72000 1.32400 -1.94700 1.000 O6 O 0.89800 -1.41600 -0.59000 1.000 O7 O 0.52900 -0.18400 -4.83900 1.000 C8 C -0.51300 0.63600 0.39400 1.000 C9 C -1.20400 -0.60800 1.00700 1.000 C10 C -0.83100 -0.48100 2.50800 1.000 C11 C 0.40900 0.43100 2.50800 1.000 O12 O -2.62000 -0.54600 0.82800 1.000 O13 O -1.90100 0.11700 3.24000 1.000 O14 O 0.71900 0.73700 1.13800 1.000 C15 C 1.58900 -0.29300 3.15900 1.000 O16 O 2.73600 0.55800 3.14800 1.000 H17 H 1.26300 -1.62400 -2.99100 1.000 H18 H -0.84100 1.83200 -3.99500 1.000 H19 H -1.29600 2.17800 -1.62300 1.000 H20 H -1.12500 1.52600 0.54200 1.000 H21 H -0.79900 -1.52700 0.58100 1.000 H22 H -0.58500 -1.45800 2.92400 1.000 H23 H 0.19300 1.35000 3.05300 1.000 H24 H -2.98800 -1.34500 1.22900 1.000 H25 H -1.61400 0.17000 4.16200 1.000 H26 H 1.80800 -1.20400 2.60200 1.000 H27 H 1.33600 -0.54800 4.18800 1.000 H28 H 3.45500 0.06400 3.56700 1.000