BAI8X9 -OEChem-04022101522D 45 48 0 0 0 0 0 0 0999 V2000 12.4624 -0.2953 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 11.7480 3.0944 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.9744 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -2.3811 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8590 -1.7791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5018 1.5252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8147 -1.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8147 -2.8404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0837 1.6058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -2.4744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -0.9798 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -0.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8590 -0.1696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4426 -0.9744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.9744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4426 -0.9744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1697 0.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1482 0.9871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9426 -1.8404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4589 1.9376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8160 0.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -1.9744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7945 0.4490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4374 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1052 1.3995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.7719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -2.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0252 -0.7623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3350 -0.3638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.6456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6438 -0.1644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4057 -2.1504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2526 -2.3773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4796 -1.5304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -3.0944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0448 2.3991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6234 -0.3465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -1.7028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 -0.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2763 2.1951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 28 1 0 0 0 0 3 7 2 0 0 0 0 3 8 2 0 0 0 0 3 10 1 0 0 0 0 3 16 1 0 0 0 0 4 26 1 0 0 0 0 4 30 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 21 2 0 0 0 0 9 29 1 0 0 0 0 9 45 1 0 0 0 0 10 26 1 0 0 0 0 10 40 1 0 0 0 0 11 26 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 12 19 1 0 0 0 0 13 15 2 0 0 0 0 13 21 1 0 0 0 0 14 17 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 32 1 0 0 0 0 18 23 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 28 1 0 0 0 0 24 41 1 0 0 0 0 25 27 2 0 0 0 0 25 42 1 0 0 0 0 27 29 1 0 0 0 0 28 29 2 0 0 0 0 30 31 2 0 0 0 0 30 43 1 0 0 0 0 31 44 1 0 0 0 0 M END $$$$