# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'PTR' 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 1.29800 0.97500 3.30200 1.000 C1 C -0.03600 0.39900 3.51200 1.000 C2 C -0.14800 -0.10600 4.92800 1.000 O3 O 0.83300 -0.50700 5.50500 1.000 O4 O -1.33900 -0.11000 5.54600 1.000 C5 C -0.25000 -0.76000 2.53800 1.000 C6 C -0.13800 -0.25400 1.12300 1.000 C7 C 1.08900 -0.25000 0.48700 1.000 C8 C -1.26400 0.19800 0.46100 1.000 C9 C 1.19400 0.21200 -0.81000 1.000 C10 C -1.16300 0.66800 -0.83400 1.000 C11 C 0.06700 0.67300 -1.47400 1.000 O12 O 0.16800 1.12900 -2.75000 1.000 P13 P -0.06500 -0.13600 -3.71700 1.000 O14 O -1.40900 -0.70500 -3.46700 1.000 O15 O 0.04000 0.33400 -5.25300 1.000 O16 O 1.05300 -1.25300 -3.41900 1.000 H17 H 1.96300 0.23500 3.47300 1.000 H18 H 1.36500 1.20400 2.32200 1.000 H19 H -0.79300 1.16400 3.33900 1.000 H20 H -1.41100 -0.43500 6.45400 1.000 H21 H 0.50600 -1.52500 2.71100 1.000 H22 H -1.24100 -1.18700 2.69400 1.000 H23 H 1.96600 -0.60900 1.00400 1.000 H24 H -2.22200 0.19400 0.95900 1.000 H25 H 2.15400 0.21600 -1.30600 1.000 H26 H -2.04100 1.02600 -1.34900 1.000 H27 H -0.10500 -0.45100 -5.79700 1.000 H28 H 1.91100 -0.84300 -3.59300 1.000