# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '98J' 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 -2.22000 -0.07900 0.00100 1.000 O1 O 0.13800 1.11000 0.00200 1.000 O2 O -2.10200 1.12300 -0.00200 1.000 O3 O -3.44200 -0.63300 0.00100 1.000 C4 C -0.99400 -0.95600 -0.00000 1.000 C5 C 0.24100 -0.09400 0.00100 1.000 C6 C 1.60600 -0.73200 -0.00100 1.000 C7 C 2.68000 0.35800 0.00000 1.000 O8 O 3.97400 -0.24700 -0.00100 1.000 H9 H -0.99800 -1.58700 0.88900 1.000 H10 H -0.99800 -1.58400 -0.89100 1.000 H11 H 1.71800 -1.35300 0.88800 1.000 H12 H 1.71700 -1.35000 -0.89100 1.000 H13 H -4.19800 -0.03000 -0.00200 1.000 H14 H 2.56800 0.97900 -0.88900 1.000 H15 H 2.56900 0.97600 0.89100 1.000 H16 H 4.70500 0.38600 -0.00000 1.000