B8TXS7 -OEChem-04022114003D 28 29 0 0 0 0 0 0 0999 V2000 -3.2185 -0.5531 -0.6673 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.3461 -1.0591 1.5210 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.9889 0.9926 1.1826 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.6915 -0.7172 -0.0198 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3727 0.7592 -1.5996 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7056 -1.7716 -1.3762 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4871 -1.2035 0.1972 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 0.3909 0.4018 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -0.0009 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 -0.2477 0.1688 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8484 1.0992 -0.1145 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2101 -0.5750 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4874 1.7156 0.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8335 2.0709 -0.1359 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 1.4292 -0.3705 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7662 -0.8433 -0.0554 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1651 0.4465 -0.3419 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7852 -1.9328 -0.0153 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0469 -1.6108 0.6405 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2596 2.4792 0.0988 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0668 3.1106 -0.3544 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4722 2.4545 -0.5937 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2020 0.6951 -0.5394 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5392 -1.7212 0.7497 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3225 -2.8958 0.2245 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2788 -2.0285 -0.9876 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 -1.0566 -0.5808 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 0.6855 -2.4448 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 9 1 0 0 0 0 2 9 1 0 0 0 0 3 9 1 0 0 0 0 4 27 1 0 0 0 0 5 28 1 0 0 0 0 7 10 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 15 17 2 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 23 1 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 M END $$$$