B9IR4K -OEChem-04012112533D 27 28 0 0 0 0 0 0 0999 V2000 3.1394 0.1905 0.7022 P 0 0 0 0 0 0 0 0 0 0 0 0 2.6505 -1.0060 -1.3316 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3694 1.1519 -1.3828 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.7426 -2.8907 0.1597 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5741 0.5430 0.0444 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6953 1.5887 1.3823 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1478 -0.9866 1.6323 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -0.1588 -0.4339 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0529 0.0295 -0.6865 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 0.7887 -0.1453 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1504 -0.5129 0.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 0.9486 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0802 -1.4388 -0.2503 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2833 -1.6162 -0.0143 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4941 1.8922 -0.0898 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5254 -0.6727 0.2779 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8576 1.7148 0.1463 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3723 0.4348 0.3299 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1593 1.9466 -0.5237 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7366 -2.3049 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1139 2.9018 -0.2306 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9853 -1.6476 0.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5175 2.5764 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4346 0.2979 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5333 -2.8917 0.7209 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3539 0.6410 0.6314 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1367 1.8751 2.2101 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 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 14 1 0 0 0 0 4 25 1 0 0 0 0 5 26 1 0 0 0 0 6 27 1 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 1 0 0 0 0 10 12 1 0 0 0 0 10 15 2 0 0 0 0 11 14 1 0 0 0 0 11 16 2 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 15 17 1 0 0 0 0 15 21 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 24 1 0 0 0 0 M END $$$$