# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'FKA' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O 1.89500 1.76000 2.51800 1.000 C1 C 2.32300 0.86300 3.41000 1.000 O2 O 2.54900 -0.28000 3.08000 1.000 C3 C 2.55400 1.28700 4.83600 1.000 C4 C 3.83700 0.61800 5.35600 1.000 C5 C 4.06000 1.06000 6.80500 1.000 C6 C 2.88300 0.57800 7.65800 1.000 C7 C 1.58800 1.22000 7.14700 1.000 N8 N 1.44000 0.89700 5.71500 1.000 C9 C 0.33500 0.29800 5.24500 1.000 O10 O 0.30700 -0.13300 4.10700 1.000 C11 C -0.90800 0.17300 6.06000 1.000 O12 O -1.05400 0.79000 7.08200 1.000 C13 C -2.01800 -0.73600 5.57900 1.000 C14 C -2.76100 -1.31400 6.78400 1.000 C15 C -3.89000 -2.22200 6.27200 1.000 C16 C -4.77400 -1.39400 5.33000 1.000 C17 C -3.90300 -0.81200 4.21400 1.000 O18 O -2.90000 0.03000 4.76800 1.000 O19 O -1.45400 -1.80600 4.81900 1.000 C20 C -1.80100 -2.15400 7.63500 1.000 O21 O -5.78300 -2.23200 4.76100 1.000 C22 C -6.91300 -2.16800 5.63300 1.000 C23 C -4.78800 0.03800 3.28900 1.000 O24 O -5.01100 1.30000 3.95500 1.000 C25 C -6.29100 1.77100 3.53000 1.000 C26 C -4.06500 0.31900 1.98600 1.000 C27 C -4.40800 -0.58700 0.81900 1.000 C28 C -5.70400 -1.36600 1.00700 1.000 C29 C -4.53500 0.26300 -0.45200 1.000 C30 C -3.46700 -0.11300 -1.45000 1.000 C31 C -3.45600 -1.50500 -2.02400 1.000 C32 C -2.57600 0.78100 -1.79900 1.000 C33 C -1.48700 0.50000 -2.79300 1.000 C34 C -2.04100 0.62600 -4.21700 1.000 C35 C -0.37800 1.51500 -2.62600 1.000 O36 O -0.35800 2.49600 -3.32900 1.000 C37 C 0.69500 1.30500 -1.58900 1.000 C38 C 1.17300 2.66600 -1.08600 1.000 O39 O 2.44100 2.98900 -1.65500 1.000 C40 C 1.21700 2.73900 0.42800 1.000 C41 C -0.20300 2.92700 0.97700 1.000 C42 C 1.84400 1.51000 1.08700 1.000 C43 C 3.24800 1.30400 0.58100 1.000 C44 C 4.27300 2.39700 0.73800 1.000 C45 C 3.57800 0.17500 0.00400 1.000 C46 C 5.02000 -0.10900 -0.32500 1.000 C47 C 5.41900 -1.46600 0.25700 1.000 C48 C 6.88300 -1.75500 -0.07700 1.000 C49 C 7.06300 -1.78000 -1.59600 1.000 C50 C 6.66500 -0.42300 -2.17900 1.000 C51 C 5.20000 -0.13400 -1.84400 1.000 O52 O 7.25500 -3.02300 0.46700 1.000 C53 C 8.65000 -2.94900 0.76900 1.000 O54 O 8.43100 -2.05000 -1.90900 1.000 C55 C -0.98300 0.15900 -5.21800 1.000 O56 O -1.54800 0.16200 -6.55600 1.000 C57 C -0.79400 -0.21400 -7.60600 1.000 O58 O 0.35800 -0.55700 -7.43400 1.000 N59 N -1.31900 -0.21100 -8.84700 1.000 C60 C -0.49900 -0.62200 -9.99000 1.000 C61 C -1.31500 -0.52900 -11.25300 1.000 C62 C -1.33100 0.64400 -11.98200 1.000 C63 C -2.07900 0.72900 -13.14100 1.000 C64 C -2.81300 -0.36000 -13.57100 1.000 C65 C -2.79600 -1.53500 -12.84300 1.000 C66 C -2.04400 -1.62100 -11.68700 1.000 H67 H 2.67600 2.37000 4.87800 1.000 H68 H 3.72000 -0.46500 5.32100 1.000 H69 H 4.68100 0.92100 4.74400 1.000 H70 H 4.98500 0.62200 7.17900 1.000 H71 H 4.12400 2.14700 6.84900 1.000 H72 H 2.80200 -0.50700 7.58200 1.000 H73 H 3.04600 0.85800 8.69700 1.000 H74 H 0.75400 0.82000 7.72100 1.000 H75 H 1.63600 2.30200 7.27400 1.000 H76 H -3.18100 -0.51300 7.38800 1.000 H77 H -4.48600 -2.57900 7.11200 1.000 H78 H -3.46900 -3.07000 5.73200 1.000 H79 H -5.24300 -0.58300 5.88500 1.000 H80 H -3.45200 -1.61400 3.63900 1.000 H81 H -0.74300 -2.18400 5.35500 1.000 H82 H -2.34300 -2.58200 8.47900 1.000 H83 H -1.38300 -2.95600 7.02700 1.000 H84 H -0.99500 -1.52100 8.00500 1.000 H85 H -7.71300 -2.79400 5.23800 1.000 H86 H -6.62800 -2.52400 6.62300 1.000 H87 H -7.26000 -1.13700 5.70400 1.000 H88 H -5.75200 -0.42600 3.18500 1.000 H89 H -6.50400 2.72600 4.00900 1.000 H90 H -6.28900 1.90000 2.44700 1.000 H91 H -7.05600 1.04600 3.80800 1.000 H92 H -4.25300 1.36400 1.69300 1.000 H93 H -2.97700 0.24700 2.16900 1.000 H94 H -3.58800 -1.30300 0.67500 1.000 H95 H -5.88200 -1.99100 0.13300 1.000 H96 H -5.62400 -1.99500 1.89400 1.000 H97 H -6.53200 -0.66800 1.13000 1.000 H98 H -5.51700 0.10100 -0.89500 1.000 H99 H -4.43000 1.31500 -0.19100 1.000 H100 H -2.57900 -1.62800 -2.66000 1.000 H101 H -3.42200 -2.23200 -1.21300 1.000 H102 H -4.35800 -1.66100 -2.61500 1.000 H103 H -2.63200 1.76700 -1.34400 1.000 H104 H -1.07000 -0.49100 -2.64800 1.000 H105 H -2.93300 0.00800 -4.31600 1.000 H106 H -2.29600 1.66700 -4.41700 1.000 H107 H 0.28900 0.71800 -0.76900 1.000 H108 H 1.52800 0.77100 -2.04500 1.000 H109 H 0.45300 3.42600 -1.44000 1.000 H110 H 2.32000 3.00800 -2.61400 1.000 H111 H 1.80600 3.61700 0.72400 1.000 H112 H -0.62600 3.85100 0.58300 1.000 H113 H -0.82400 2.08500 0.67400 1.000 H114 H -0.16700 2.97900 2.06500 1.000 H115 H 1.24500 0.62600 0.89100 1.000 H116 H 5.19000 2.11300 0.22100 1.000 H117 H 3.88700 3.32200 0.30900 1.000 H118 H 4.48500 2.54800 1.79600 1.000 H119 H 2.81500 -0.55100 -0.23300 1.000 H120 H 5.65100 0.66900 0.10200 1.000 H121 H 4.78800 -2.24500 -0.17000 1.000 H122 H 5.29000 -1.44800 1.34000 1.000 H123 H 7.51400 -0.97600 0.35000 1.000 H124 H 6.43200 -2.55900 -2.02400 1.000 H125 H 6.79300 -0.44000 -3.26200 1.000 H126 H 7.29600 0.35500 -1.75100 1.000 H127 H 4.56900 -0.91200 -2.27200 1.000 H128 H 4.91600 0.83200 -2.26000 1.000 H129 H 8.98100 -3.89800 1.19000 1.000 H130 H 9.20900 -2.74000 -0.14200 1.000 H131 H 8.82300 -2.15100 1.49200 1.000 H132 H 8.50100 -2.05700 -2.87400 1.000 H133 H -0.12700 0.83300 -5.18400 1.000 H134 H -0.66100 -0.84900 -4.96200 1.000 H135 H -2.23900 0.06100 -8.98400 1.000 H136 H 0.36800 0.03300 -10.06900 1.000 H137 H -0.16500 -1.65000 -9.84700 1.000 H138 H -0.75800 1.49600 -11.64500 1.000 H139 H -2.09200 1.64700 -13.70900 1.000 H140 H -3.39800 -0.29300 -14.47600 1.000 H141 H -3.36900 -2.38600 -13.17900 1.000 H142 H -2.03100 -2.53900 -11.11800 1.000