# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'F9K' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy F0 F -9.49500 -2.64000 2.17300 1.000 C1 C -9.82500 -2.43100 0.88000 1.000 C2 C -8.83000 -2.21800 -0.06300 1.000 C3 C -9.16900 -2.00500 -1.38400 1.000 C4 C -10.50000 -2.00400 -1.76500 1.000 C5 C -11.49100 -2.21600 -0.82600 1.000 C6 C -11.15400 -2.43500 0.49600 1.000 C7 C -7.90700 -1.80400 -2.18400 1.000 N8 N -6.77200 -1.90900 -1.26100 1.000 C9 C -7.33000 -2.16800 0.07000 1.000 C10 C -5.46700 -1.79000 -1.57600 1.000 O11 O -5.13700 -1.57400 -2.72500 1.000 O12 O -4.53000 -1.91100 -0.61800 1.000 C13 C -3.14400 -1.77100 -1.02900 1.000 C14 C -2.69900 -0.30900 -0.89700 1.000 N15 N -1.57400 -0.25800 0.04200 1.000 C16 C -1.48800 -1.54000 0.75000 1.000 C17 C -2.23100 -2.58400 -0.09700 1.000 C18 C -0.05900 -1.95500 0.94900 1.000 N19 N 0.41300 -3.07200 0.32900 1.000 C20 C 1.75400 -3.53500 0.74100 1.000 C21 C 1.78600 -4.64200 1.80000 1.000 C22 C 2.14800 -4.95900 0.34700 1.000 C23 C 2.90800 -4.61100 2.80600 1.000 C24 C 2.64000 -4.51200 4.08400 1.000 C25 C 2.82800 -2.48600 0.79100 1.000 N26 N 4.13900 -2.85700 0.64100 1.000 S27 S 5.24900 -1.64300 0.93300 1.000 C28 C 6.54900 -1.85200 -0.23600 1.000 C29 C 6.89900 -0.79700 -1.06600 1.000 C30 C 7.92400 -0.94300 -1.98900 1.000 C31 C 8.60100 -2.14600 -2.07100 1.000 C32 C 8.25100 -3.20100 -1.24500 1.000 C33 C 7.22200 -3.05200 -0.32500 1.000 F34 F 8.91100 -4.37600 -1.33400 1.000 N35 N 6.21400 0.42200 -0.95000 1.000 C36 C 6.59000 1.53700 -1.83100 1.000 C37 C 5.77700 2.77200 -1.43700 1.000 C38 C 4.37300 2.65500 -2.03300 1.000 C39 C 3.52300 3.84000 -1.56900 1.000 C40 C 2.10100 3.68500 -2.11000 1.000 C41 C 1.17900 3.21100 -0.98300 1.000 C42 C 0.11000 2.27900 -1.56200 1.000 C43 C -1.00700 2.08000 -0.53500 1.000 C44 C -0.76400 0.80300 0.22900 1.000 O45 O 0.15900 0.73100 1.01200 1.000 N46 N -1.02300 3.21100 0.39500 1.000 C47 C -1.71900 4.32400 0.09100 1.000 O48 O -2.33300 4.39000 -0.95300 1.000 C49 C -1.73500 5.48800 1.04900 1.000 C50 C -2.59300 6.61400 0.46600 1.000 C51 C -2.37600 7.87500 1.31000 1.000 C52 C -0.94000 8.36000 1.10600 1.000 N53 N 0.00200 7.26500 1.30900 1.000 C54 C -0.33100 5.97500 1.26600 1.000 O55 O 0.54600 5.15000 1.40900 1.000 C56 C 1.40100 7.60500 1.57700 1.000 O57 O 4.60400 -0.42000 0.60400 1.000 O58 O 5.81000 -1.91000 2.21100 1.000 O59 O 2.53700 -1.32100 0.96300 1.000 O60 O 0.67300 -1.29800 1.65900 1.000 H61 H -11.92800 -2.60600 1.23000 1.000 H62 H -7.04600 -1.36600 0.75200 1.000 H63 H -6.96000 -3.12200 0.44600 1.000 H64 H -10.76400 -1.83600 -2.79900 1.000 H65 H -7.83000 -2.57300 -2.95300 1.000 H66 H -7.91600 -0.81700 -2.64700 1.000 H67 H -12.52800 -2.21400 -1.12600 1.000 H68 H -3.02400 -2.10900 -2.05900 1.000 H69 H -2.38500 0.07000 -1.87000 1.000 H70 H -3.52400 0.29400 -0.51800 1.000 H71 H -2.82800 -3.23400 0.54300 1.000 H72 H -1.52200 -3.17100 -0.68000 1.000 H73 H -1.98500 -1.44700 1.71800 1.000 H74 H -0.10300 -3.53800 -0.34700 1.000 H75 H 0.83100 -5.01100 2.17300 1.000 H76 H 1.43000 -5.53700 -0.23600 1.000 H77 H 3.19700 -5.14600 0.11800 1.000 H78 H 3.93400 -4.67100 2.47300 1.000 H79 H 3.44400 -4.48900 4.80500 1.000 H80 H 1.61400 -4.45200 4.41700 1.000 H81 H 4.40300 -3.75400 0.38400 1.000 H82 H 6.95000 -3.87500 0.31900 1.000 H83 H 8.19100 -0.12400 -2.63900 1.000 H84 H 5.50200 0.52700 -0.29900 1.000 H85 H 9.40600 -2.26400 -2.78200 1.000 H86 H 7.65400 1.74900 -1.71700 1.000 H87 H 6.37700 1.27300 -2.86600 1.000 H88 H 5.70800 2.83200 -0.35100 1.000 H89 H 6.26300 3.66800 -1.82300 1.000 H90 H 4.43900 2.65900 -3.12100 1.000 H91 H 3.91300 1.72500 -1.69900 1.000 H92 H 3.49700 3.86400 -0.47900 1.000 H93 H 3.95600 4.76700 -1.94400 1.000 H94 H 1.75000 4.64400 -2.48900 1.000 H95 H 2.09700 2.95100 -2.91600 1.000 H96 H 1.76400 2.67400 -0.23600 1.000 H97 H 0.69900 4.07300 -0.52000 1.000 H98 H -0.30400 2.72100 -2.46800 1.000 H99 H 0.55900 1.31600 -1.80100 1.000 H100 H -1.96600 2.01900 -1.05000 1.000 H101 H -0.53200 3.15900 1.23000 1.000 H102 H -2.15700 5.16700 2.00100 1.000 H103 H -2.29500 6.80600 -0.56500 1.000 H104 H -3.64500 6.32800 0.49700 1.000 H105 H -3.07200 8.65200 0.99400 1.000 H106 H -2.53700 7.64300 2.36300 1.000 H107 H -0.83000 8.74600 0.09300 1.000 H108 H -0.72400 9.15700 1.81700 1.000 H109 H 1.55100 7.70600 2.65200 1.000 H110 H 2.04700 6.81400 1.19300 1.000 H111 H 1.64800 8.54600 1.08600 1.000