# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'DTH' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N 0.40200 -1.69200 -0.30000 1.000 C1 C 0.05400 -0.31000 -0.65800 1.000 C2 C 1.08500 0.64800 -0.05800 1.000 C3 C 2.47300 0.31300 -0.60800 1.000 O4 O 1.09100 0.51100 1.36500 1.000 C5 C -1.31300 0.02000 -0.11600 1.000 O6 O -1.78100 -0.63700 0.78400 1.000 O7 O -2.01100 1.04300 -0.63300 1.000 H8 H 1.35800 -1.83400 -0.59000 1.000 H9 H 0.39400 -1.74100 0.70800 1.000 H10 H 0.04900 -0.20600 -1.74300 1.000 H11 H 0.82700 1.67300 -0.32300 1.000 H12 H 3.20800 0.99500 -0.18000 1.000 H13 H 2.73100 -0.71200 -0.34200 1.000 H14 H 2.46900 0.41700 -1.69300 1.000 H15 H 1.75200 1.13000 1.70300 1.000 H16 H -2.88900 1.25400 -0.28600 1.000