# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '5TY' 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 0.17000 -0.77700 -0.00400 1.000 C1 C 1.11900 -1.88700 -0.00400 1.000 C2 C -0.21600 1.61200 -0.00200 1.000 C3 C 4.38600 -0.16400 0.00400 1.000 C4 C -3.84600 -1.49400 0.00500 1.000 C5 C 0.68300 0.54500 -0.00200 1.000 C6 C 2.13400 0.73000 0.00100 1.000 C7 C -1.95900 0.09000 -0.00200 1.000 N8 N -1.14800 -0.95700 -0.00100 1.000 N9 N 2.93400 -0.35600 0.00100 1.000 N10 N -1.51000 1.34200 -0.00400 1.000 C11 C 2.43800 -1.62500 -0.00100 1.000 N12 N -3.32200 -0.12600 0.00100 1.000 O13 O 2.61300 1.85000 0.00300 1.000 C14 C -4.24400 1.01200 0.00100 1.000 H15 H 0.76500 -2.90700 -0.00500 1.000 H16 H 0.13600 2.63300 0.00000 1.000 H17 H 4.74500 -0.11700 1.03200 1.000 H18 H 4.86400 -0.99800 -0.51000 1.000 H19 H 4.63100 0.76700 -0.50900 1.000 H20 H -3.97400 -1.83100 1.03400 1.000 H21 H -4.80800 -1.51600 -0.50700 1.000 H22 H -3.14600 -2.15300 -0.50800 1.000 H23 H 3.13200 -2.45300 -0.00100 1.000 H24 H -4.47100 1.29600 1.02800 1.000 H25 H -3.78300 1.85400 -0.51600 1.000 H26 H -5.16500 0.73300 -0.51100 1.000