B29NIY -OEChem-04012116152D 37 39 0 1 0 0 0 0 0999 V2000 4.2213 3.3318 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.1682 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 2.5000 2.8706 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -0.3318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 1.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 1.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 1.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 2.6627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.2882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0593 1.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6608 1.7508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -1.5218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.9518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -1.5218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6438 1.4782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -3.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4497 -0.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -3.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.2882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.9518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4497 1.4782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 1.9398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 2 8 1 0 0 0 0 3 19 1 0 0 0 0 3 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 6 10 2 0 0 0 0 6 12 1 0 0 0 0 7 11 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 18 1 0 0 0 0 9 19 2 0 0 0 0 10 14 1 0 0 0 0 10 26 1 0 0 0 0 11 15 1 0 0 0 0 11 27 1 0 0 0 0 12 16 2 0 0 0 0 12 28 1 0 0 0 0 13 17 2 0 0 0 0 13 29 1 0 0 0 0 14 20 2 0 0 0 0 14 30 1 0 0 0 0 15 21 2 0 0 0 0 15 31 1 0 0 0 0 16 20 1 0 0 0 0 16 32 1 0 0 0 0 17 21 1 0 0 0 0 17 33 1 0 0 0 0 18 22 2 0 0 0 0 18 34 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 M END $$$$