# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '068' 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 7.87800 1.45800 -0.16800 1.000 C1 C 7.13300 0.20300 -0.54100 1.000 O2 O 7.72500 -0.72700 -1.04700 1.000 C3 C 5.68700 0.10500 -0.29200 1.000 C4 C 4.99300 -1.06000 -0.63900 1.000 C5 C 3.64500 -1.14900 -0.40600 1.000 C6 C 5.00300 1.17600 0.29600 1.000 C7 C 3.65500 1.08300 0.52700 1.000 C8 C 2.96400 -0.07800 0.17600 1.000 C9 C 1.50700 -0.17600 0.42600 1.000 C10 C 0.82300 0.89100 1.00700 1.000 C11 C -0.53400 0.79400 1.23800 1.000 C12 C 0.81300 -1.33400 0.07700 1.000 C13 C -0.54400 -1.42000 0.31200 1.000 C14 C -1.21600 -0.36000 0.89400 1.000 C15 C -2.69800 -0.46000 1.14900 1.000 C16 C -3.46200 0.05200 -0.07400 1.000 C17 C -4.96600 -0.05000 0.18500 1.000 O18 O -5.33600 -1.42400 0.31400 1.000 C19 C -5.72900 0.57500 -0.98400 1.000 C20 C -7.20300 0.58600 -0.67500 1.000 O21 O -8.07200 1.09200 -1.56400 1.000 O22 O -7.60300 0.14000 0.37400 1.000 H23 H 8.93200 1.34500 -0.42600 1.000 H24 H 7.46000 2.30500 -0.71200 1.000 H25 H 7.78300 1.63200 0.90400 1.000 H26 H 5.51900 -1.88900 -1.08900 1.000 H27 H 5.53700 2.07400 0.56900 1.000 H28 H 3.10900 -2.04700 -0.67300 1.000 H29 H 3.12700 1.90800 0.98100 1.000 H30 H 1.35500 1.79200 1.27700 1.000 H31 H 1.33700 -2.16200 -0.37800 1.000 H32 H -1.06500 1.62000 1.68800 1.000 H33 H -1.08200 -2.31600 0.04100 1.000 H34 H -2.96500 -1.50000 1.33600 1.000 H35 H -2.95800 0.14400 2.01900 1.000 H36 H -3.19500 1.09200 -0.26000 1.000 H37 H -3.20100 -0.55200 -0.94300 1.000 H38 H -5.21300 0.48000 1.10500 1.000 H39 H -5.14400 -1.95800 -0.46900 1.000 H40 H -5.38200 1.59700 -1.13900 1.000 H41 H -5.55100 -0.00900 -1.88800 1.000 H42 H -9.00800 1.07700 -1.32000 1.000