# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9LB' 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 3.17800 3.50700 0.17800 1.000 C1 C 3.84600 2.34400 -0.31700 1.000 C2 C 3.20200 1.09300 0.28200 1.000 C3 C 3.99200 -0.14500 -0.15000 1.000 O4 O 5.32500 -0.06300 0.36100 1.000 C5 C 3.30700 -1.39800 0.40400 1.000 O6 O 3.99700 -2.56200 -0.05500 1.000 O7 O 1.85500 0.98100 -0.18100 1.000 C8 C 1.14900 -0.14600 0.34200 1.000 C9 C 1.85700 -1.43400 -0.08800 1.000 N10 N 1.16800 -2.59200 0.49700 1.000 C11 C -0.26100 -0.14700 -0.19000 1.000 N12 N -0.61700 -0.30300 -1.43700 1.000 N13 N -1.89800 -0.25100 -1.54000 1.000 C14 C -2.43000 -0.05600 -0.35400 1.000 N15 N -1.39800 0.00900 0.54200 1.000 C16 C -3.87200 0.06200 -0.04500 1.000 C17 C -4.81700 -0.03200 -1.06700 1.000 C18 C -6.16100 0.07900 -0.77300 1.000 C19 C -6.57100 0.28400 0.53200 1.000 C20 C -5.63900 0.37800 1.55000 1.000 C21 C -4.29300 0.26400 1.26900 1.000 H22 H 3.53500 4.33900 -0.16100 1.000 H23 H 3.76100 2.31200 -1.40300 1.000 H24 H 4.89800 2.38200 -0.03600 1.000 H25 H 3.20700 1.16600 1.37000 1.000 H26 H 4.02200 -0.19700 -1.23800 1.000 H27 H 5.81600 0.71100 0.05300 1.000 H28 H 3.32200 -1.37000 1.49400 1.000 H29 H 4.92400 -2.60200 0.21500 1.000 H30 H 1.12700 -0.08900 1.43000 1.000 H31 H 1.84300 -1.51200 -1.17500 1.000 H32 H 1.62100 -3.45400 0.23200 1.000 H33 H 1.11000 -2.50800 1.50100 1.000 H34 H -4.49800 -0.19200 -2.08700 1.000 H35 H -6.89300 0.00600 -1.56400 1.000 H36 H -7.62400 0.37000 0.75700 1.000 H37 H -5.96600 0.53800 2.56700 1.000 H38 H -3.56700 0.33300 2.06600 1.000 H39 H -1.46300 0.14200 1.50100 1.000