94G Converted by convert_cif2sdf.py 2024/03/29 11:09:15 30 31 0 0 0 0 0 0 0 0999 V2000 -1.9308 -0.3085 0.2499 C 0 0 0 0 0 3.4601 -0.3259 -0.3235 C 0 0 0 0 0 -3.1540 -0.5824 0.8499 C 0 0 0 0 0 0.2680 -1.0157 -0.3017 C 0 0 0 0 0 -2.7069 1.7121 -0.5508 C 0 0 0 0 0 -4.1818 0.3391 0.7341 C 0 0 0 0 0 4.3382 -0.5377 0.7223 C 0 0 0 0 0 3.2147 0.9588 -0.7718 C 0 0 0 0 0 4.7278 1.8210 0.8720 C 0 0 0 0 0 -3.9467 1.5075 0.0185 C 0 0 0 0 0 4.9732 0.5349 1.3207 C 0 0 0 0 0 3.8486 2.0327 -0.1738 C 0 0 0 0 0 -1.7468 0.8159 -0.4236 N 0 0 0 0 0 1.2390 -1.9504 -0.2748 N 0 0 0 0 0 -0.8864 -1.2250 0.3629 N 0 0 0 0 0 0.4336 0.0151 -0.9246 O 0 0 0 0 0 2.2968 -1.2668 -2.3968 O 0 0 0 0 0 3.4748 -2.8292 -0.8418 O 0 0 0 0 0 2.6575 -1.6937 -1.0906 S 0 0 0 0 0 -5.8659 0.0149 1.5315 BR 0 0 0 0 0 5.5239 3.1686 1.6235 CL 0 0 0 0 0 -3.3014 -1.5002 1.3984 H 0 0 0 0 0 -2.5195 2.6187 -1.1077 H 0 0 0 0 0 4.5292 -1.5410 1.0722 H 0 0 0 0 0 2.5291 1.1241 -1.5890 H 0 0 0 0 0 -4.7267 2.2463 -0.0895 H 0 0 0 0 0 5.6589 0.3696 2.1379 H 0 0 0 0 0 3.6575 3.0364 -0.5245 H 0 0 0 0 0 1.1069 -2.7729 0.2222 H 0 0 0 0 0 -0.9898 -2.0121 0.9194 H 0 0 0 0 0 18 19 2 0 0 0 8 12 2 0 0 0 8 2 1 0 0 0 12 9 1 0 0 0 19 2 1 0 0 0 19 17 2 0 0 0 19 14 1 0 0 0 2 7 2 0 0 0 9 21 1 0 0 0 9 11 2 0 0 0 7 11 1 0 0 0 14 4 1 0 0 0 4 16 2 0 0 0 4 15 1 0 0 0 15 1 1 0 0 0 1 13 2 0 0 0 1 3 1 0 0 0 13 5 1 0 0 0 3 6 2 0 0 0 5 10 2 0 0 0 6 10 1 0 0 0 6 20 1 0 0 0 3 22 1 0 0 0 5 23 1 0 0 0 7 24 1 0 0 0 8 25 1 0 0 0 10 26 1 0 0 0 11 27 1 0 0 0 12 28 1 0 0 0 14 29 1 0 0 0 15 30 1 0 0 0 M END $$$$