# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0TA' 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 5.04400 -0.39100 0.00700 1.000 N1 N 0.55500 0.92300 0.07200 1.000 C2 C 0.97500 2.32600 0.12500 1.000 C3 C 0.26000 3.04600 1.28100 1.000 C4 C -0.56700 4.18500 0.64800 1.000 C5 C -0.79200 3.72300 -0.81300 1.000 C6 C 0.55800 3.05100 -1.17100 1.000 C7 C -1.19200 -0.77700 0.00800 1.000 C8 C -2.63800 -1.11100 -0.00400 1.000 C9 C -3.31900 -1.78300 0.97000 1.000 O10 O -1.58600 1.51200 0.09600 1.000 C11 C -0.75700 0.61900 0.06100 1.000 N12 N -4.60600 -1.87700 0.57700 1.000 N13 N -4.73000 -1.25000 -0.66900 1.000 C14 C -3.56000 -0.78500 -1.01800 1.000 C15 C -0.25500 -1.77200 -0.03100 1.000 C16 C 1.11600 -1.42300 -0.02900 1.000 C17 C 2.11600 -2.40600 -0.07300 1.000 C18 C 1.75700 -3.86800 -0.12400 1.000 C19 C 1.50300 -0.06800 0.02800 1.000 N20 N 2.79900 0.22600 0.03800 1.000 C21 C 3.70700 -0.73700 -0.00500 1.000 N22 N 3.37900 -2.02300 -0.05900 1.000 H23 H 5.30300 0.54300 0.04600 1.000 H24 H 5.72400 -1.08200 -0.02000 1.000 H25 H 2.05500 2.38800 0.25700 1.000 H26 H -0.39900 2.35200 1.80300 1.000 H27 H 0.99300 3.45800 1.97500 1.000 H28 H -1.52000 4.29600 1.16400 1.000 H29 H -0.00900 5.12100 0.67300 1.000 H30 H -1.60800 3.00300 -0.86900 1.000 H31 H -0.98600 4.57600 -1.46200 1.000 H32 H 1.29800 3.80400 -1.44200 1.000 H33 H 0.42400 2.33600 -1.98300 1.000 H34 H -2.90200 -2.17000 1.88800 1.000 H35 H -5.32200 -2.30600 1.07100 1.000 H36 H -3.33600 -0.25100 -1.93000 1.000 H37 H -0.55700 -2.80900 -0.07000 1.000 H38 H 1.66200 -4.18400 -1.16300 1.000 H39 H 2.53800 -4.45200 0.36300 1.000 H40 H 0.81000 -4.02800 0.39200 1.000