B2U3QL -OEChem-04012115562D 33 35 0 0 0 0 0 0 0999 V2000 6.9851 3.6756 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 -2.4803 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2204 -3.0667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 -3.4319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1756 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -1.6756 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 0.0797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6756 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 -0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6995 0.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0102 1.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3423 1.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9887 1.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6530 2.9313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2993 2.3932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6315 3.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6139 -1.6756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.8656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7201 -0.3337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3133 0.1986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7356 1.8529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4027 0.9812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9060 2.5210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8241 3.7268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 5 9 1 0 0 0 0 6 9 2 0 0 0 0 7 12 1 0 0 0 0 7 24 1 0 0 0 0 8 12 2 0 0 0 0 8 17 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 13 15 2 0 0 0 0 13 25 1 0 0 0 0 14 16 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 30 1 0 0 0 0 20 22 2 0 0 0 0 20 31 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 23 33 1 0 0 0 0 M CHG 2 5 -1 9 1 M END $$$$