M6ADRUG0082 -OEChem-08152207073D 58 62 0 1 0 0 0 0 0999 V2000 -3.0968 2.3854 1.9554 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.0385 -3.5160 -0.3484 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 0.0543 -2.2316 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5972 0.8923 0.7349 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4499 -3.2249 0.6521 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4549 -1.6942 0.8516 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4418 -0.9537 0.0094 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0156 -3.7307 0.8334 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3274 -1.5710 -0.4416 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6281 -0.9445 -1.4366 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0238 -2.9822 -0.0272 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7206 0.4533 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3534 -3.8759 1.7161 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9988 -3.6082 -0.7376 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0764 0.8344 -1.6622 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9472 -0.4468 -0.8518 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6081 1.3926 0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4321 2.0245 -2.3041 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9413 2.5935 -0.5058 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3704 2.8786 -1.7461 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9454 0.5596 0.1116 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1495 -1.0027 -1.2838 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1693 1.2615 1.4799 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8343 3.5271 0.0483 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1519 1.0125 0.6456 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3558 -0.5499 -0.7498 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0498 2.2011 2.0271 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3571 0.4577 0.2147 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3939 3.3290 1.3042 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1628 0.2545 1.9053 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3078 1.9889 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4682 -1.3347 0.6343 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -1.4879 1.9065 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6872 -3.6182 1.8742 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9572 -4.7955 0.5769 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8754 -1.7295 -2.1649 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 -3.5233 1.6262 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0094 -3.6406 2.7296 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3611 -4.9669 1.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0107 -4.6967 -0.8664 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4038 -3.1904 -1.5555 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0266 -3.2494 -0.8643 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3462 0.3643 -3.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9642 2.3020 -3.2463 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6184 3.7950 -2.2785 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0113 0.9946 0.4543 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1656 -1.7882 -2.0343 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9066 0.4341 2.1275 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0941 4.4347 -0.4944 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2883 -0.9907 -1.0937 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4538 2.0478 3.0236 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0761 4.0626 1.7219 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6748 -0.6702 1.6197 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8881 0.9045 2.4063 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3884 0.0052 2.6391 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3401 2.0565 0.4708 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3517 1.8571 -0.9757 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8154 2.9431 0.3226 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 11 2 0 0 0 0 3 10 1 0 0 0 0 3 15 1 0 0 0 0 3 43 1 0 0 0 0 4 28 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 9 2 0 0 0 0 7 12 1 0 0 0 0 8 11 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 16 1 0 0 0 0 10 36 1 0 0 0 0 12 15 2 0 0 0 0 12 17 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 18 1 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 17 19 1 0 0 0 0 17 23 2 0 0 0 0 18 20 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 45 1 0 0 0 0 21 25 1 0 0 0 0 21 46 1 0 0 0 0 22 26 2 0 0 0 0 22 47 1 0 0 0 0 23 27 1 0 0 0 0 23 48 1 0 0 0 0 24 29 1 0 0 0 0 24 49 1 0 0 0 0 25 28 2 0 0 0 0 26 28 1 0 0 0 0 26 50 1 0 0 0 0 27 29 2 0 0 0 0 27 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END $$$$