BKJS91 -OEChem-04022113033D 25 26 0 1 0 0 0 0 0999 V2000 5.5927 0.4369 0.0981 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7153 -2.1366 0.6094 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2236 0.7966 0.0773 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1268 -1.4618 -0.2523 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5696 0.3546 0.2473 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5497 -1.0709 -0.3004 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5046 -0.3386 -0.0846 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9526 -0.1531 -0.0415 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4888 1.2675 -0.4902 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8002 -1.2513 -0.1888 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4884 1.1208 0.1471 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1832 -1.0755 -0.1473 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8715 1.2967 0.1887 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7189 0.1986 0.0415 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4292 2.0162 0.0958 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 0.3832 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8595 -1.1009 -1.3524 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3705 1.3415 -1.5686 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4054 -2.2529 -0.3367 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8588 1.9983 0.2652 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4535 -3.2612 -0.0726 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8298 -1.9415 -0.2637 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2731 2.2959 0.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0602 2.6689 -0.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5871 1.9924 1.1684 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 6 1 0 0 0 0 2 21 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 4 6 1 0 0 0 0 4 7 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 15 2 0 0 0 0 9 18 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 11 13 2 0 0 0 0 11 20 1 0 0 0 0 12 14 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 M END $$$$