B7K4AP -OEChem-04012118042D 37 39 0 0 0 0 0 0 0999 V2000 4.4487 2.6243 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.1724 0.7696 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4324 2.0297 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8633 1.7207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4814 -0.1814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.9218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2004 -2.5091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 0.4606 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9324 0.4909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1234 1.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9324 -0.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7414 1.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0664 -1.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 -1.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4324 2.0297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 1.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0664 -2.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 -2.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 2.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9324 -2.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 2.5310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 3.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2004 -3.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3311 0.8871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0924 -0.1458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5295 -0.6991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3354 -0.6991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7968 2.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3354 -2.3191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9324 -3.1291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0677 3.6380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3323 4.1156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8548 3.3802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5804 -3.5091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2004 -4.1291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8204 -3.5091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 3 11 1 0 0 0 0 3 16 1 0 0 0 0 6 9 1 0 0 0 0 6 17 1 0 0 0 0 7 18 1 0 0 0 0 7 24 1 0 0 0 0 8 17 1 0 0 0 0 8 26 1 0 0 0 0 9 22 2 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 16 2 0 0 0 0 13 25 1 0 0 0 0 14 18 1 0 0 0 0 14 27 1 0 0 0 0 15 19 2 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 17 20 2 0 0 0 0 18 21 2 0 0 0 0 19 21 1 0 0 0 0 19 30 1 0 0 0 0 20 22 1 0 0 0 0 21 31 1 0 0 0 0 22 23 1 0 0 0 0 23 32 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 M END $$$$