9NK Converted by convert_cif2sdf.py 2024/03/29 11:09:15 42 43 0 0 0 0 0 0 0 0999 V2000 3.6162 0.7555 -0.6485 C 0 0 0 0 0 -3.6955 -0.4324 -0.8537 C 0 0 0 0 0 -2.9234 0.8872 -0.9227 C 0 0 0 0 0 -1.4293 0.5921 -1.0870 C 0 0 0 0 0 -1.7355 -1.5572 0.2085 C 0 0 0 0 0 -3.2257 -1.2381 0.3592 C 0 0 0 0 0 -1.2350 -2.2306 1.4603 C 0 0 0 0 0 2.9753 0.3473 0.5060 C 0 0 0 0 0 2.1049 1.3142 1.2669 C 0 0 0 0 0 0.7160 1.3619 0.6276 C 0 0 0 0 0 -0.1261 2.4382 1.3178 C 0 0 0 0 0 0.0445 0.0221 0.7825 C 0 0 0 0 0 3.1316 -0.9484 0.9612 C 0 0 0 0 0 3.9299 -1.8356 0.2630 C 0 0 0 0 0 4.5716 -1.4262 -0.8906 C 0 0 0 0 0 4.4093 -0.1327 -1.3505 C 0 0 0 0 0 -1.0014 -0.3028 -0.0023 N 0 0 0 0 0 0.4452 -0.7640 1.6152 O 0 0 0 0 0 -0.6648 -3.4442 1.3879 O 0 0 0 0 0 -1.3455 -1.6788 2.5290 O 0 0 0 0 0 0.6346 4.0634 1.0534 S 0 0 0 0 0 3.4930 1.7682 -1.0052 H 0 0 0 0 0 -4.7621 -0.2239 -0.7618 H 0 0 0 0 0 -3.5153 -1.0065 -1.7627 H 0 0 0 0 0 -3.2743 1.4708 -1.7735 H 0 0 0 0 0 -3.0837 1.4508 -0.0037 H 0 0 0 0 0 -1.2569 0.1087 -2.0493 H 0 0 0 0 0 -0.8652 1.5229 -1.0399 H 0 0 0 0 0 -1.5878 -2.2183 -0.6459 H 0 0 0 0 0 -3.3833 -0.6547 1.2666 H 0 0 0 0 0 -3.7930 -2.1665 0.4203 H 0 0 0 0 0 2.0168 0.9858 2.3028 H 0 0 0 0 0 2.5530 2.3071 1.2373 H 0 0 0 0 0 0.8114 1.5998 -0.4320 H 0 0 0 0 0 -1.1327 2.4350 0.8984 H 0 0 0 0 0 -0.1764 2.2291 2.3864 H 0 0 0 0 0 2.6304 -1.2675 1.8638 H 0 0 0 0 0 4.0519 -2.8476 0.6197 H 0 0 0 0 0 5.1959 -2.1188 -1.4355 H 0 0 0 0 0 4.9106 0.1864 -2.2521 H 0 0 0 0 0 -0.3591 -3.8360 2.2176 H 0 0 0 0 0 -0.1971 4.8962 1.7035 H 0 0 0 0 0 16 15 2 0 0 0 16 1 1 0 0 0 15 14 1 0 0 0 1 8 2 0 0 0 14 13 2 0 0 0 8 13 1 0 0 0 8 9 1 0 0 0 18 12 2 0 0 0 9 10 1 0 0 0 20 7 2 0 0 0 5 6 1 0 0 0 5 7 1 0 0 0 5 17 1 0 0 0 12 17 1 0 0 0 12 10 1 0 0 0 6 2 1 0 0 0 7 19 1 0 0 0 17 4 1 0 0 0 10 11 1 0 0 0 11 21 1 0 0 0 4 3 1 0 0 0 2 3 1 0 0 0 1 22 1 0 0 0 2 23 1 0 0 0 2 24 1 0 0 0 3 25 1 0 0 0 3 26 1 0 0 0 4 27 1 0 0 0 4 28 1 0 0 0 5 29 1 0 0 0 6 30 1 0 0 0 6 31 1 0 0 0 9 32 1 0 0 0 9 33 1 0 0 0 10 34 1 0 0 0 11 35 1 0 0 0 11 36 1 0 0 0 13 37 1 0 0 0 14 38 1 0 0 0 15 39 1 0 0 0 16 40 1 0 0 0 19 41 1 0 0 0 21 42 1 0 0 0 M END $$$$