9DE Converted by convert_cif2sdf.py 2024/03/29 11:09:15 32 33 0 0 0 0 0 0 0 0999 V2000 -0.0993 1.3696 1.2937 C 0 0 0 0 0 -1.1959 0.5322 1.2403 C 0 0 0 0 0 -1.7540 0.1980 0.0196 C 0 0 0 0 0 -3.1531 -0.8709 -0.0439 S 0 0 0 0 0 -3.1506 -1.4582 -1.3384 O 0 0 0 0 0 -3.1316 -1.6333 1.1556 O 0 0 0 0 0 -4.5029 0.0845 0.0332 N 0 0 0 0 0 -1.2155 0.7008 -1.1508 C 0 0 0 0 0 -0.1178 1.5377 -1.1045 C 0 0 0 0 0 0.4402 1.8810 0.1207 C 0 0 0 0 0 1.5495 2.7285 0.1710 N 0 0 0 0 0 2.8259 2.4831 -0.8561 S 0 0 0 0 0 2.2790 2.4087 -2.1650 O 0 0 0 0 0 3.8263 3.4217 -0.4837 O 0 0 0 0 0 3.4833 0.8881 -0.4994 C 0 0 0 0 0 3.0772 -0.2072 -1.2386 C 0 0 0 0 0 3.5933 -1.4590 -0.9603 C 0 0 0 0 0 4.5165 -1.6156 0.0583 C 0 0 0 0 0 5.2228 -3.3276 0.4393 BR 0 0 0 0 0 4.9218 -0.5192 0.7974 C 0 0 0 0 0 4.4100 0.7329 0.5148 C 0 0 0 0 0 0.3350 1.6308 2.2478 H 0 0 0 0 0 -1.6187 0.1378 2.1521 H 0 0 0 0 0 -5.3231 -0.1981 -0.4015 H 0 0 0 0 0 -4.4748 0.9266 0.5129 H 0 0 0 0 0 -1.6534 0.4378 -2.1024 H 0 0 0 0 0 0.3016 1.9302 -2.0189 H 0 0 0 0 0 1.5724 3.4592 0.8078 H 0 0 0 0 0 2.3568 -0.0852 -2.0336 H 0 0 0 0 0 3.2763 -2.3149 -1.5376 H 0 0 0 0 0 5.6456 -0.6403 1.5901 H 0 0 0 0 0 4.7261 1.5891 1.0922 H 0 0 0 0 0 20 21 2 0 0 0 20 18 1 0 0 0 21 15 1 0 0 0 14 12 2 0 0 0 19 18 1 0 0 0 18 17 2 0 0 0 15 12 1 0 0 0 15 16 2 0 0 0 12 11 1 0 0 0 12 13 2 0 0 0 11 10 1 0 0 0 17 16 1 0 0 0 10 1 2 0 0 0 10 9 1 0 0 0 1 2 1 0 0 0 9 8 2 0 0 0 2 3 2 0 0 0 8 3 1 0 0 0 3 4 1 0 0 0 7 4 1 0 0 0 6 4 2 0 0 0 4 5 2 0 0 0 1 22 1 0 0 0 2 23 1 0 0 0 7 24 1 0 0 0 7 25 1 0 0 0 8 26 1 0 0 0 9 27 1 0 0 0 11 28 1 0 0 0 16 29 1 0 0 0 17 30 1 0 0 0 20 31 1 0 0 0 21 32 1 0 0 0 M END $$$$