B5BT2L -OEChem-04042103493D 49 52 0 0 0 0 0 0 0999 V2000 -2.2996 2.7151 0.0494 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3833 -2.9603 1.7002 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.1125 -3.4992 -0.0068 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4702 1.3075 0.8601 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2833 1.1362 0.2159 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4852 1.7164 -1.2633 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6201 -2.6481 0.7582 N 0 3 0 0 0 0 0 0 0 0 0 0 7.1413 -2.0258 -0.4453 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4395 2.2569 1.4206 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 0.0153 0.5945 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 2.4283 0.4835 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3137 0.1866 -0.3438 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6732 1.1435 1.7555 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4255 1.3010 -0.6812 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8734 0.5877 1.0362 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3761 0.1363 -0.5983 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6475 1.4005 0.2043 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2089 -0.7493 1.2091 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7613 0.9056 -0.4685 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3177 -1.2705 0.5484 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0956 -0.4530 -0.2888 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2397 0.0154 0.4848 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 -0.8228 -1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2165 -0.9516 -0.9661 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0950 -1.0742 0.5138 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2872 -1.8750 -1.4824 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9646 -0.1187 -1.7856 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5598 1.1961 -1.8992 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 1.9249 2.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9669 3.2381 1.5515 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4158 -0.6731 0.1057 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -0.4605 1.5282 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 2.9040 -0.4519 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3539 3.1075 0.9652 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9625 0.5176 -1.3308 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7686 -0.8016 -0.4732 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 2.1123 2.1794 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4171 0.5265 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0023 2.1943 -0.4023 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1081 1.4773 -1.7181 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6077 -1.3840 1.8565 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2521 0.7450 1.2874 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7344 -0.7607 -2.4638 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5317 -1.9878 -0.8739 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9363 3.1326 -0.5564 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7881 -1.2143 1.3368 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3404 -2.6495 -2.2405 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8342 -0.4873 -2.3167 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1057 1.8938 -2.5257 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 45 1 0 0 0 0 2 7 1 0 0 0 0 3 7 2 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 6 19 1 0 0 0 0 6 28 2 0 0 0 0 7 20 1 0 0 0 0 8 25 2 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 15 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 16 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 17 1 0 0 0 0 15 18 2 0 0 0 0 16 22 2 0 0 0 0 16 23 1 0 0 0 0 17 19 2 0 0 0 0 18 20 1 0 0 0 0 18 41 1 0 0 0 0 19 21 1 0 0 0 0 20 21 2 0 0 0 0 21 24 1 0 0 0 0 22 25 1 0 0 0 0 22 42 1 0 0 0 0 23 26 2 0 0 0 0 23 43 1 0 0 0 0 24 27 2 0 0 0 0 24 44 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 M CHG 2 2 -1 7 1 M END $$$$