# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9T6' 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 1.78000 2.46100 0.54300 1.000 C1 C 3.47100 -1.16100 -0.62600 1.000 C2 C 2.78900 3.23800 0.11900 1.000 C3 C 2.15200 1.07900 0.23200 1.000 C4 C 2.21900 -1.31300 -0.02000 1.000 C5 C 1.53400 -0.16600 0.42500 1.000 C6 C 3.41200 1.14000 -0.38700 1.000 C7 C 1.62700 -2.65000 0.15000 1.000 C8 C -1.71300 1.79900 0.69000 1.000 C9 C -2.48700 -0.28100 1.83900 1.000 C10 C -4.02200 0.93500 0.28700 1.000 C11 C -2.30400 0.79700 -1.52100 1.000 C12 C -3.07800 -1.28200 -0.37300 1.000 C13 C -2.91400 1.09700 1.32900 1.000 C14 C -1.19500 0.96000 -0.48000 1.000 C15 C -1.96900 -1.12000 0.66900 1.000 C16 C -0.76800 -0.41800 0.03000 1.000 C17 C -3.50400 0.09600 -0.88300 1.000 N18 N 4.01500 0.02300 -0.78800 1.000 N19 N 3.77000 2.46300 -0.44000 1.000 N20 N 2.23600 -3.72900 -0.37900 1.000 N21 N 0.29600 -0.26200 1.03100 1.000 O22 O 0.58700 -2.78000 0.76900 1.000 O23 O -4.54000 -0.05600 -1.85600 1.000 H24 H 0.87100 2.79000 1.02400 1.000 H25 H 4.00200 -2.03700 -0.96900 1.000 H26 H 2.82200 4.31400 0.20600 1.000 H27 H -2.01700 2.78000 0.32700 1.000 H28 H -0.92300 1.91400 1.43200 1.000 H29 H -1.69700 -0.16500 2.58100 1.000 H30 H -3.34300 -0.78000 2.29300 1.000 H31 H -4.87800 0.43500 0.74200 1.000 H32 H -4.32600 1.91700 -0.07700 1.000 H33 H -2.60700 1.77900 -1.88500 1.000 H34 H -1.93400 0.20000 -2.35500 1.000 H35 H -2.70900 -1.88000 -1.20700 1.000 H36 H -3.93300 -1.78200 0.08200 1.000 H37 H -3.28300 1.69500 2.16200 1.000 H38 H -0.34000 1.45900 -0.93400 1.000 H39 H -1.66600 -2.10100 1.03200 1.000 H40 H -0.39900 -1.01600 -0.80300 1.000 H41 H 4.59700 2.80000 -0.81800 1.000 H42 H 3.06500 -3.62500 -0.87200 1.000 H43 H 1.84600 -4.61000 -0.26700 1.000 H44 H 0.27800 -1.01900 1.69800 1.000 H45 H -4.86000 0.78000 -2.22400 1.000