BRY9S5 -OEChem-04042103533D 45 47 0 0 0 0 0 0 0999 V2000 -3.7200 -0.9418 -4.0312 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2767 -2.1711 1.8096 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6331 0.4951 0.4573 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1358 2.8849 -0.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3322 -2.7970 2.5839 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0141 -2.8602 1.6243 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7362 -1.8197 0.2601 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0028 -0.5877 2.4229 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1745 -1.8426 -1.9686 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8152 1.4810 1.0699 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2371 0.3317 1.6329 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0111 2.3529 0.2978 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3475 2.0496 0.1117 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1144 0.0460 1.4377 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9052 0.9033 0.6785 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1738 1.7843 1.2562 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 3.5022 -0.2652 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9471 -1.8326 0.2069 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7314 2.9307 0.6894 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9406 3.7880 -0.0699 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0978 -1.7104 -0.8929 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3249 -1.6891 0.0433 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5213 -1.1182 -0.3637 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6262 -1.4445 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8533 -1.4231 -1.2198 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -1.3009 -2.3195 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2146 2.6171 -2.0288 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9147 -1.6278 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -0.8292 1.9089 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7392 -0.1812 3.0119 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8351 1.1445 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0035 4.2016 -0.8571 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7839 3.1533 0.8395 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3753 4.6810 -0.5096 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0221 -1.8207 -0.7905 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0039 -1.7721 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0183 -1.8494 0.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9462 -1.0173 -1.2891 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9504 -1.3520 -3.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9290 -1.3119 -1.3298 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2448 2.7760 -2.5104 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5556 1.5956 -2.2222 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 3.3112 -2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4861 -1.6756 -2.6954 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0807 -2.1826 -2.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 8 1 0 0 0 0 2 18 1 0 0 0 0 3 15 1 0 0 0 0 3 23 1 0 0 0 0 4 13 1 0 0 0 0 4 27 1 0 0 0 0 7 28 2 0 0 0 0 8 11 1 0 0 0 0 8 30 1 0 0 0 0 9 28 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 2 0 0 0 0 11 14 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 15 2 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 16 19 1 0 0 0 0 16 31 1 0 0 0 0 17 20 1 0 0 0 0 17 32 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 24 1 0 0 0 0 21 35 1 0 0 0 0 22 25 2 0 0 0 0 22 36 1 0 0 0 0 23 28 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 26 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 M END $$$$