# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'FKK' 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 -4.62100 0.05400 0.01100 1.000 N1 N 0.30100 -0.98800 -0.50700 1.000 C2 C -3.78000 0.41300 -1.02800 1.000 O3 O -6.58600 0.69100 1.51800 1.000 N4 N 2.49400 0.60600 0.13800 1.000 C5 C -2.53600 -0.17100 -1.14500 1.000 O6 O -0.68500 -2.96400 -0.27200 1.000 S7 S -6.20900 0.80500 0.15300 1.000 O8 O -6.12800 2.04800 -0.53000 1.000 C9 C -4.22200 -0.89500 0.93600 1.000 C10 C -2.98000 -1.48600 0.83000 1.000 C11 C -2.12600 -1.12500 -0.21300 1.000 C12 C -0.79300 -1.75500 -0.33200 1.000 C13 C 0.18400 0.46900 -0.66600 1.000 C14 C 1.14000 1.14400 0.32400 1.000 C15 C 1.64500 -1.58700 -0.53900 1.000 C16 C 2.53900 -0.82600 0.44600 1.000 C17 C 3.47100 1.34700 0.94600 1.000 C18 C 4.86600 0.93600 0.54900 1.000 C19 C 5.52700 1.61700 -0.45600 1.000 C20 C 6.80600 1.24100 -0.82100 1.000 C21 C 7.42500 0.18200 -0.17900 1.000 F22 F 8.67500 -0.18600 -0.53400 1.000 C23 C 6.76200 -0.49900 0.82800 1.000 C24 C 5.48500 -0.11700 1.19500 1.000 N25 N -7.27200 -0.13200 -0.70500 1.000 H26 H -4.09900 1.15100 -1.74800 1.000 H27 H -1.88100 0.10900 -1.95700 1.000 H28 H -4.88500 -1.17300 1.74200 1.000 H29 H -2.67100 -2.22700 1.55300 1.000 H30 H 0.45400 0.74900 -1.68400 1.000 H31 H -0.84000 0.77900 -0.45900 1.000 H32 H 0.80700 0.94700 1.34300 1.000 H33 H 1.14800 2.22000 0.14500 1.000 H34 H 1.58600 -2.63500 -0.24500 1.000 H35 H 2.05600 -1.51100 -1.54500 1.000 H36 H 3.56500 -1.18300 0.35500 1.000 H37 H 2.18400 -0.99200 1.46300 1.000 H38 H 3.34500 2.41700 0.77700 1.000 H39 H 3.31300 1.12500 2.00100 1.000 H40 H 5.04300 2.44300 -0.95600 1.000 H41 H 7.32100 1.77300 -1.60700 1.000 H42 H 7.24400 -1.32500 1.32900 1.000 H43 H 4.97000 -0.64600 1.98300 1.000 H44 H -6.95700 -0.92700 -1.16200 1.000 H45 H -8.20800 0.11600 -0.75100 1.000