BSM9H4 -OEChem-04022109542D 50 54 0 1 0 0 0 0 0999 V2000 2.0000 1.0252 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 7.7096 -1.5047 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.9719 2.4573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3252 -1.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1245 1.6061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3676 -0.5650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0516 -2.4444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4684 -0.1366 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7699 -1.8467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0039 -1.2040 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0770 -0.0832 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7349 0.8564 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.4497 0.5088 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.7085 1.4747 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.8486 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2920 -0.6932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7416 0.8192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1074 0.9659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1908 -0.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5287 -0.4787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3550 -1.4635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7626 0.1641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4153 -1.8055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8230 -0.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6493 -1.1627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0642 -1.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2981 -0.9032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3584 -1.2452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4718 0.0816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5924 -0.6024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7057 0.7244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 0.3824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3677 -0.8820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4442 1.6552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0778 1.9727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1349 -0.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6573 1.2522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5920 -0.2967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0304 -1.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7897 -0.6176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8300 -1.8620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8703 0.7747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3077 -2.4161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3480 0.2206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6622 -2.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9565 -2.1566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2508 -1.8558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0544 0.2937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0098 -0.8145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8134 1.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 9 1 0 0 0 0 2 25 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 16 2 0 0 0 0 5 17 2 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 10 26 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 11 33 1 6 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 12 34 1 6 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 14 18 1 0 0 0 0 14 35 1 0 0 0 0 15 18 2 0 0 0 0 15 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 42 1 0 0 0 0 23 25 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 47 1 0 0 0 0 29 31 2 0 0 0 0 29 48 1 0 0 0 0 30 32 2 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 M END $$$$