BD39GS -OEChem-04012114332D 26 27 0 0 0 0 0 0 0999 V2000 6.0010 -2.1344 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.0486 0.9588 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.1344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.1344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4964 3.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7122 1.5975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2177 2.5680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.8656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2395 2.3601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 1.7020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -0.3244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.7544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4699 3.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9169 -3.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.7544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1569 -3.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 12 1 0 0 0 0 2 17 1 0 0 0 0 3 11 1 0 0 0 0 3 18 1 0 0 0 0 4 9 1 0 0 0 0 4 23 1 0 0 0 0 5 16 2 0 0 0 0 6 17 2 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 10 12 2 0 0 0 0 10 19 1 0 0 0 0 11 14 2 0 0 0 0 12 16 1 0 0 0 0 13 15 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 M END $$$$