BK5SJ6 -OEChem-04012115023D 38 40 0 1 0 0 0 0 0999 V2000 -3.0394 -3.2025 0.1710 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.6258 -0.8294 -1.3382 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0097 1.7492 -0.4704 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7916 -2.1402 -1.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9656 0.3689 -2.0815 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 2.9436 -0.1868 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1499 1.8613 0.6259 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4053 -0.7948 0.1717 N 0 0 1 0 0 0 0 0 0 0 0 0 -3.9995 -0.1909 0.3508 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4808 0.5151 0.8957 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1045 0.1849 2.3425 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0595 -1.8613 1.1508 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4748 -1.2791 2.4915 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8959 1.0623 0.7652 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0604 -0.6847 -0.8296 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6351 0.5822 -0.7018 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8065 -1.8509 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9527 0.6278 -0.3023 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6967 -0.5169 -0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -1.7747 -0.1549 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3137 2.2864 -0.6539 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8427 1.7640 -0.0735 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1854 1.1796 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7721 1.2466 0.4998 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0208 0.2987 2.4735 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5966 0.8221 3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6101 -2.7793 0.9282 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9948 -2.0813 1.1899 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5568 -1.3835 2.6352 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9687 -1.7609 3.3328 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 0.2608 0.8179 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0953 1.7776 1.5719 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0888 1.4942 -0.9095 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3443 -2.8299 -0.6689 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3402 2.8020 -1.6176 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0597 1.4860 -0.6655 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 3.0082 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 -0.8805 0.5902 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 14 1 0 0 0 0 3 21 1 0 0 0 0 6 22 2 0 0 0 0 7 23 2 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 9 19 1 0 0 0 0 9 23 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 24 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 33 1 0 0 0 0 17 20 2 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 M END $$$$