B3A1WJ -OEChem-04012120282D 34 36 0 0 0 0 0 0 0999 V2000 11.2625 -2.8100 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 0.7141 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5381 1.2175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8989 -0.1499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9056 1.5782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0663 2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 -1.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0663 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0663 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1724 0.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2663 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1724 -1.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2663 -0.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6644 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5304 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6644 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3964 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5304 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3964 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1796 1.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3353 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1796 -1.9646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7306 -1.1429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5304 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1275 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9334 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5304 -3.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 14 1 0 0 0 0 3 33 1 0 0 0 0 6 19 1 0 0 0 0 6 34 1 0 0 0 0 7 19 2 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 10 16 1 0 0 0 0 11 15 2 0 0 0 0 11 19 1 0 0 0 0 12 14 2 0 0 0 0 12 25 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 14 17 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 22 1 0 0 0 0 20 29 1 0 0 0 0 21 23 2 0 0 0 0 21 30 1 0 0 0 0 22 24 2 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 M END $$$$