# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0KE' 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 -4.50800 -0.08900 1.95800 1.000 C1 C -5.79300 -0.44600 1.67500 1.000 C2 C -5.32900 -0.38100 -0.69100 1.000 C3 C 4.42700 1.11200 0.54300 1.000 C4 C -3.59800 0.13200 0.91500 1.000 C5 C 3.19000 0.72300 0.06600 1.000 C6 C 2.23600 1.69000 -0.20900 1.000 C7 C -4.01400 -0.01700 -0.42100 1.000 C8 C -6.20900 -0.60000 0.35400 1.000 C9 C 2.56600 3.02300 0.00700 1.000 C10 C 3.82900 3.33600 0.48800 1.000 C11 C -2.21600 0.51500 1.20100 1.000 C12 C -1.36500 0.71900 0.15800 1.000 C13 C -1.84900 0.55100 -1.21100 1.000 C14 C 4.20100 4.77700 0.72700 1.000 C15 C -8.35500 -1.15600 1.21000 1.000 C16 C 0.87600 1.30600 -0.73200 1.000 C17 C 2.88100 -0.73600 -0.15200 1.000 N18 N 4.70600 2.38500 0.74300 1.000 N19 N -3.12400 0.19800 -1.45300 1.000 N20 N -0.03600 1.08700 0.39500 1.000 O21 O 5.43000 -3.68600 0.69900 1.000 O22 O 3.91800 -3.56500 -1.44800 1.000 O23 O -1.08800 0.73400 -2.14500 1.000 O24 O 2.91100 -3.69300 0.86300 1.000 O25 O 1.66300 4.00700 -0.25000 1.000 O26 O -3.56000 0.04400 -2.79200 1.000 O27 O -7.49300 -0.95700 0.08900 1.000 O28 O 4.02000 -1.52300 0.20400 1.000 P29 P 4.04500 -3.12900 0.09600 1.000 H30 H -4.19200 0.02900 2.98400 1.000 H31 H -6.49400 -0.61200 2.48000 1.000 H32 H -5.65900 -0.50200 -1.71200 1.000 H33 H 5.17400 0.36200 0.76000 1.000 H34 H -1.87700 0.63400 2.21900 1.000 H35 H 3.94100 5.05400 1.74900 1.000 H36 H 5.27300 4.90500 0.57800 1.000 H37 H 3.65800 5.41300 0.02900 1.000 H38 H -9.34900 -1.43700 0.86000 1.000 H39 H -7.95500 -1.95100 1.84000 1.000 H40 H -8.42100 -0.23400 1.78700 1.000 H41 H 0.48900 2.10600 -1.36200 1.000 H42 H 0.95600 0.38900 -1.31700 1.000 H43 H 2.03200 -1.02500 0.46800 1.000 H44 H 2.63800 -0.90300 -1.20100 1.000 H45 H 0.28200 1.19700 1.30400 1.000 H46 H 5.51400 -4.64800 0.66700 1.000 H47 H 4.62900 -3.23000 -2.01100 1.000 H48 H 1.10200 4.23200 0.50400 1.000 H49 H -2.87400 0.21400 -3.45100 1.000