J7J Converted by convert_cif2sdf.py 2024/03/29 11:09:15 41 43 0 0 0 0 0 0 0 0999 V2000 6.9788 0.8652 0.7021 C 0 0 0 0 0 6.7341 -0.4245 0.2433 C 0 0 0 0 0 9.1029 -0.6767 -0.0470 C 0 0 0 0 0 -0.1207 1.1157 -0.1462 C 0 0 0 0 0 0.7276 0.0249 -0.0045 C 0 0 0 0 0 2.0501 0.3304 -0.0252 C 0 0 0 0 0 -1.5436 0.9529 -0.1380 C 0 0 0 0 0 -2.7101 0.8197 -0.1305 C 0 0 0 0 0 -4.1331 0.6568 -0.1223 C 0 0 0 0 0 -4.6932 -0.6147 0.0256 C 0 0 0 0 0 -6.0641 -0.7633 0.0331 C 0 0 0 0 0 -6.8846 0.3427 -0.1048 C 0 0 0 0 0 -6.3368 1.6052 -0.2511 C 0 0 0 0 0 -4.9672 1.7697 -0.2553 C 0 0 0 0 0 -6.6707 -2.1341 0.1914 C 0 0 0 0 0 9.2896 0.5523 0.3988 N 0 0 0 0 0 8.2815 1.3223 0.7638 C 0 0 0 0 0 7.8281 -1.2104 -0.1395 C 0 0 0 0 0 8.5977 2.9342 1.3286 CL 0 0 0 0 0 5.4311 -0.9246 0.1668 N 0 0 0 0 0 4.3901 -0.0764 0.0515 C 0 0 0 0 0 4.5893 1.1148 -0.0904 O 0 0 0 0 0 0.4253 2.2986 -0.2829 N 0 0 0 0 0 2.1079 2.0882 -0.2378 S 0 0 0 0 0 3.1286 -0.5479 0.0944 N 0 0 0 0 0 0.0918 -1.7443 0.2034 BR 0 0 0 0 0 -6.8727 -2.4081 1.5794 O 0 0 0 0 0 7.6359 -2.5147 -0.6127 N 0 0 0 0 0 6.1602 1.5029 1.0023 H 0 0 0 0 0 9.9543 -1.2749 -0.3359 H 0 0 0 0 0 -4.0541 -1.4790 0.1324 H 0 0 0 0 0 -7.9576 0.2201 -0.0985 H 0 0 0 0 0 -6.9826 2.4639 -0.3541 H 0 0 0 0 0 -4.5414 2.7560 -0.3695 H 0 0 0 0 0 -7.6280 -2.1698 -0.3279 H 0 0 0 0 0 -5.9985 -2.8800 -0.2324 H 0 0 0 0 0 5.2755 -1.8817 0.1975 H 0 0 0 0 0 2.9698 -1.4976 0.2071 H 0 0 0 0 0 -7.2612 -3.2750 1.7574 H 0 0 0 0 0 8.3986 -3.0511 -0.8781 H 0 0 0 0 0 6.7403 -2.8808 -0.6733 H 0 0 0 0 0 28 18 1 0 0 0 26 5 1 0 0 0 18 3 2 0 0 0 18 2 1 0 0 0 13 14 2 0 0 0 13 12 1 0 0 0 14 9 1 0 0 0 3 16 1 0 0 0 20 2 1 0 0 0 20 21 1 0 0 0 25 21 1 0 0 0 25 6 1 0 0 0 5 6 2 0 0 0 5 4 1 0 0 0 2 1 2 0 0 0 12 11 2 0 0 0 21 22 2 0 0 0 6 24 1 0 0 0 16 17 2 0 0 0 9 8 1 0 0 0 9 10 2 0 0 0 8 7 3 0 0 0 7 4 1 0 0 0 4 23 2 0 0 0 1 17 1 0 0 0 17 19 1 0 0 0 11 10 1 0 0 0 11 15 1 0 0 0 24 23 1 0 0 0 15 27 1 0 0 0 1 29 1 0 0 0 3 30 1 0 0 0 10 31 1 0 0 0 12 32 1 0 0 0 13 33 1 0 0 0 14 34 1 0 0 0 15 35 1 0 0 0 15 36 1 0 0 0 20 37 1 0 0 0 25 38 1 0 0 0 27 39 1 0 0 0 28 40 1 0 0 0 28 41 1 0 0 0 M END $$$$