# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0KG' 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 -5.06700 -0.94800 0.85900 1.000 C1 C -6.31900 -0.07600 0.97500 1.000 C2 C -6.72300 0.42300 -0.41400 1.000 C3 C -5.58100 1.24700 -1.01200 1.000 C4 C -4.32900 0.37500 -1.12800 1.000 C5 C -3.92500 -0.12400 0.26100 1.000 N6 N -2.72600 -0.95900 0.15000 1.000 C7 C -1.50500 -0.38700 0.14200 1.000 O8 O -1.39900 0.81800 0.22600 1.000 C9 C -0.27200 -1.24600 0.02800 1.000 O10 O 0.89000 -0.41500 0.04100 1.000 C11 C 2.09500 -1.03700 -0.05400 1.000 C12 C 2.15700 -2.41800 -0.15800 1.000 C13 C 3.38200 -3.04900 -0.25500 1.000 C14 C 4.54700 -2.30300 -0.24800 1.000 C15 C 4.48800 -0.92500 -0.14400 1.000 C16 C 3.26400 -0.29000 -0.05300 1.000 P17 P 3.18700 1.51800 0.07500 1.000 O18 O 3.23000 1.94800 1.62600 1.000 O19 O 4.44400 2.16400 -0.69600 1.000 O20 O 1.93000 2.00200 -0.53700 1.000 H21 H -4.77900 -1.30300 1.84900 1.000 H22 H -5.27600 -1.80100 0.21300 1.000 H23 H -7.13200 -0.66300 1.40100 1.000 H24 H -6.10900 0.77700 1.62000 1.000 H25 H -6.93200 -0.43000 -1.06000 1.000 H26 H -7.61500 1.04400 -0.33100 1.000 H27 H -5.86900 1.60300 -2.00100 1.000 H28 H -5.37100 2.10000 -0.36600 1.000 H29 H -4.53800 -0.47800 -1.77300 1.000 H30 H -3.51500 0.96200 -1.55400 1.000 H31 H -3.71500 0.72900 0.90700 1.000 H32 H -2.81100 -1.92200 0.08300 1.000 H33 H -0.23300 -1.93900 0.86900 1.000 H34 H -0.30600 -1.80800 -0.90500 1.000 H35 H 1.24700 -3.00100 -0.16300 1.000 H36 H 3.43100 -4.12400 -0.33600 1.000 H37 H 5.50400 -2.79700 -0.32400 1.000 H38 H 5.39800 -0.34500 -0.13800 1.000 H39 H 4.02800 1.66300 2.09200 1.000 H40 H 4.46700 3.13100 -0.66900 1.000