# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C9K' 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 2.00100 -0.16200 0.41700 1.000 C1 C 0.85500 0.74200 -0.04200 1.000 C2 C -1.52300 0.81100 -0.49400 1.000 N3 N -0.39800 -0.02600 -0.05700 1.000 N4 N 2.05600 -1.35500 -0.43700 1.000 C5 C 3.32300 0.60000 0.31400 1.000 C6 C -2.80700 -0.02100 -0.49700 1.000 O7 O -3.12400 -0.41300 0.84000 1.000 H8 H 1.83400 -0.46300 1.45200 1.000 H9 H 0.75700 1.58200 0.64500 1.000 H10 H 1.06500 1.11400 -1.04400 1.000 H11 H -1.63700 1.65200 0.19000 1.000 H12 H -1.32900 1.18400 -1.50000 1.000 H13 H -0.31200 -0.84700 -0.63700 1.000 H14 H 1.21900 -1.91000 -0.33800 1.000 H15 H 2.21000 -1.10300 -1.40200 1.000 H16 H 3.28300 1.48600 0.94800 1.000 H17 H 4.14000 -0.04300 0.64100 1.000 H18 H 3.49000 0.90100 -0.72000 1.000 H19 H -3.62400 0.57300 -0.90500 1.000 H20 H -2.66200 -0.91000 -1.11200 1.000 H21 H -3.92800 -0.94500 0.91400 1.000