# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'IWX' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O 1.31900 -0.59900 0.98200 1.000 C1 C 2.14100 0.13200 0.47100 1.000 N2 N 1.77000 1.33900 0.00100 1.000 C3 C 0.41700 1.70400 -0.00200 1.000 C4 C -0.56400 0.72800 -0.03000 1.000 C5 C -1.90900 1.09400 -0.03300 1.000 C6 C -2.26300 2.44200 -0.00900 1.000 C7 C -1.28400 3.41400 0.01800 1.000 C8 C 0.05600 3.05200 0.02700 1.000 N9 N 1.04600 4.03900 0.05400 1.000 C10 C -2.96300 0.05100 -0.06300 1.000 C11 C -4.30800 0.41500 -0.06600 1.000 C12 C -5.28500 -0.55900 -0.09400 1.000 C13 C -4.93000 -1.89800 -0.11700 1.000 F14 F -5.88900 -2.84900 -0.14300 1.000 C15 C -3.59400 -2.26500 -0.11400 1.000 C16 C -2.61000 -1.29800 -0.09300 1.000 C17 C 3.57900 -0.30800 0.36600 1.000 C18 C 3.73300 -1.70500 0.97600 1.000 C19 C 5.17800 -2.17600 0.79400 1.000 O20 O 5.50900 -2.16900 -0.59600 1.000 C21 C 5.42900 -0.88000 -1.20800 1.000 C22 C 3.99400 -0.35700 -1.10700 1.000 H23 H 2.43900 1.95600 -0.33500 1.000 H24 H -0.28800 -0.31600 -0.04800 1.000 H25 H -3.30500 2.72600 -0.01300 1.000 H26 H -1.56000 4.45800 0.03600 1.000 H27 H 0.79600 4.97700 0.06700 1.000 H28 H 1.98200 3.78700 0.06100 1.000 H29 H -4.58500 1.45900 -0.04700 1.000 H30 H -6.32700 -0.27700 -0.09600 1.000 H31 H -3.32200 -3.31000 -0.13300 1.000 H32 H -1.56900 -1.58400 -0.09400 1.000 H33 H 4.21500 0.39600 0.90200 1.000 H34 H 3.49200 -1.66800 2.03800 1.000 H35 H 3.05700 -2.39800 0.47400 1.000 H36 H 5.84900 -1.50500 1.33100 1.000 H37 H 5.28300 -3.18700 1.18800 1.000 H38 H 6.10300 -0.19200 -0.69700 1.000 H39 H 5.71500 -0.95700 -2.25700 1.000 H40 H 3.32500 -1.02300 -1.65200 1.000 H41 H 3.94000 0.64400 -1.53500 1.000