B2SV1X -OEChem-04022117563D 35 36 0 1 0 0 0 0 0999 V2000 -4.2939 -2.1592 0.9903 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.3321 -1.8286 -0.3711 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2391 2.5969 0.1263 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9662 -1.6925 -1.7673 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5536 -3.1361 0.2155 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1701 -0.0100 -1.0949 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7781 1.3597 -0.1039 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0344 0.5002 0.2786 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3847 1.2225 0.4991 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5274 0.6324 -0.3542 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1166 -0.9888 0.6151 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7796 -0.8443 -0.0689 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0893 1.1380 1.1047 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4394 0.8251 0.5267 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1295 -0.3143 0.9407 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0029 1.6743 -0.4256 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3833 -0.6043 0.4025 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2566 1.3841 -0.9639 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9468 0.2449 -0.5498 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7844 0.6096 -0.7867 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6502 1.1977 1.5633 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2816 0.7654 -1.4156 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3838 -1.1493 1.6652 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1831 -1.5176 0.4108 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5715 -1.2476 -0.7098 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0675 -1.0092 0.9758 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0172 2.2294 1.1404 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0398 0.8139 2.1526 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 2.3461 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5051 1.0178 -0.7312 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9798 2.6269 -0.8105 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6969 -0.9664 1.6959 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 2.5635 -0.7585 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6824 2.0550 -1.7054 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3885 0.6908 -1.7329 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 9 1 0 0 0 0 3 31 1 0 0 0 0 6 19 1 0 0 0 0 6 35 1 0 0 0 0 7 10 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 15 32 1 0 0 0 0 16 18 2 0 0 0 0 16 33 1 0 0 0 0 17 19 2 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 M END $$$$