# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9H8' 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 4.32900 -0.97000 -0.20000 1.000 C1 C 3.41100 -0.27100 -1.22800 1.000 C2 C 2.43700 0.57600 -0.38800 1.000 N3 N 2.77100 0.33900 1.03300 1.000 C4 C 4.20500 -0.06700 1.05300 1.000 C5 C 0.99700 0.14100 -0.66400 1.000 N6 N 0.09000 0.85100 0.24100 1.000 S7 S -1.53800 0.87100 -0.06400 1.000 O8 O -2.08200 1.65800 0.98700 1.000 O9 O -1.63500 1.28900 -1.41900 1.000 C10 C -2.05100 -0.86100 0.10600 1.000 F11 F -3.42500 -0.96500 -0.13300 1.000 F12 F -1.35500 -1.64600 -0.81900 1.000 F13 F -1.76800 -1.30600 1.40200 1.000 H14 H 3.97100 -1.97700 0.01400 1.000 H15 H 5.35900 -0.99600 -0.55600 1.000 H16 H 3.99900 0.37000 -1.88600 1.000 H17 H 2.86400 -1.01100 -1.81200 1.000 H18 H 2.55800 1.63300 -0.62600 1.000 H19 H 2.62400 1.17100 1.58300 1.000 H20 H 4.43400 -0.62700 1.95900 1.000 H21 H 4.85300 0.80600 0.96500 1.000 H22 H 0.73800 0.37700 -1.69600 1.000 H23 H 0.90400 -0.93300 -0.50300 1.000 H24 H 0.44300 1.31000 1.02000 1.000