BK3QL1 -OEChem-04022102033D 44 46 0 1 0 0 0 0 0999 V2000 1.4536 0.9267 1.5159 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8327 0.4146 -0.2555 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3663 3.8933 0.1714 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 0.1576 0.1041 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4944 -0.1148 1.2559 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6853 -0.8138 0.2256 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9746 -0.3187 1.0457 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2183 1.5124 0.3007 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2363 0.0388 -1.2827 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -0.2727 -0.3257 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7807 -0.1538 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5536 1.3463 -0.4504 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6915 0.5120 -1.3044 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4595 -2.2737 -0.1503 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5166 2.7987 -0.1207 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8565 -1.6935 -0.8291 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7455 -3.0806 0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3327 -2.8786 0.6862 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0229 -0.5130 2.1446 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0324 -0.7942 1.2716 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5263 -0.9224 1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4707 1.6160 1.3676 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3269 0.5938 -2.0425 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2394 -0.9925 -1.6383 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7841 -0.4322 -0.2703 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6989 -0.4305 -1.6669 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5355 1.8212 -1.4383 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3709 1.8083 0.1152 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 0.4172 -2.3231 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7475 1.5834 -1.0813 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1889 -2.3691 -1.2072 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4173 2.9435 0.4274 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3041 2.8153 -1.1935 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4271 -2.2657 -0.0882 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4769 -1.6637 -1.7332 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9585 -2.2594 -1.0769 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2074 0.4523 -1.1522 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1313 -3.0042 1.0444 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5676 -4.1413 -0.1877 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5289 -2.7480 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5284 -2.7748 1.7588 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6417 -2.4707 0.4614 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2571 -3.9539 0.4839 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 4.7007 -0.1044 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 7 1 0 0 0 0 2 10 1 0 0 0 0 2 37 1 0 0 0 0 3 15 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 6 11 1 0 0 0 0 6 14 1 0 0 0 0 6 20 1 0 0 0 0 7 10 1 0 0 0 0 7 21 1 0 0 0 0 8 12 1 0 0 0 0 8 15 1 0 0 0 0 8 22 1 0 0 0 0 9 13 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 M END $$$$