# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9IP' 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 8.62700 -3.50900 -0.46200 1.000 O1 O 7.60300 -2.89500 0.32300 1.000 C2 C 6.35800 -2.84200 -0.21200 1.000 C3 C 6.09700 -3.36700 -1.46700 1.000 N4 N 4.88000 -3.35000 -2.05600 1.000 C5 C 3.87900 -2.77800 -1.35000 1.000 C6 C 4.03900 -2.22600 -0.09100 1.000 C7 C 5.30400 -2.26100 0.48300 1.000 C8 C 2.92100 -1.63100 0.60800 1.000 C9 C 1.88500 -1.03600 -0.11200 1.000 C10 C 0.80700 -0.46300 0.56100 1.000 C11 C 0.76400 -0.48400 1.95500 1.000 C12 C 1.80000 -1.07900 2.67600 1.000 C13 C 1.75300 -1.10000 4.16600 1.000 N14 N 2.38000 0.05800 4.75100 1.000 C15 C 2.51500 0.25600 6.11700 1.000 C16 C 2.03200 -0.69500 7.02500 1.000 C17 C 2.17100 -0.49700 8.39400 1.000 C18 C 2.79600 0.66400 8.82100 1.000 N19 N 3.28000 1.61300 7.98900 1.000 C20 C 3.12700 1.38500 6.66500 1.000 N21 N 3.62500 2.36300 5.76700 1.000 C22 C 2.87800 -1.65200 2.00200 1.000 H23 H 9.05100 -4.35400 0.08700 1.000 H24 H 9.40700 -2.77600 -0.68400 1.000 H25 H 8.19100 -3.86900 -1.39800 1.000 H26 H 6.88100 -3.83400 -2.05400 1.000 H27 H 2.91600 -2.78300 -1.85200 1.000 H28 H 5.47700 -1.84000 1.47100 1.000 H29 H 1.90400 -1.01200 -1.20000 1.000 H30 H -0.00000 -0.00100 -0.00000 1.000 H31 H -0.08100 -0.03600 2.47200 1.000 H32 H 0.71700 -1.13400 4.53000 1.000 H33 H 2.26000 -1.98700 4.57200 1.000 H34 H 2.74500 0.77200 4.12800 1.000 H35 H 1.54500 -1.59600 6.66100 1.000 H36 H 1.80100 -1.22600 9.10500 1.000 H37 H 2.92900 0.86600 9.87900 1.000 H38 H 4.58800 2.61300 5.81400 1.000 H39 H 2.98200 2.84400 5.17700 1.000 H40 H 3.68300 -2.11400 2.57000 1.000