J97 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 43 45 0 0 0 0 0 0 0 0999 V2000 -2.6992 1.5713 -0.6498 C 0 0 0 0 0 -0.9802 -0.5095 -0.6128 C 0 0 0 0 0 0.2558 -1.0428 -0.2013 C 0 0 0 0 0 1.4790 -0.2385 -0.2766 C 0 0 0 0 0 0.2945 -2.3707 0.2850 C 0 0 0 0 0 -2.0303 -2.5799 -0.0489 C 0 0 0 0 0 -2.1286 -1.3184 -0.5220 C 0 0 0 0 0 -3.2696 -3.4323 0.0407 C 0 0 0 0 0 3.8144 0.0176 0.0929 C 0 0 0 0 0 5.0260 -0.6433 -0.0436 C 0 0 0 0 0 6.2023 0.0903 -0.1922 C 0 0 0 0 0 6.1529 1.4865 -0.2018 C 0 0 0 0 0 4.9427 2.1345 -0.0650 C 0 0 0 0 0 3.7763 1.4061 0.0818 C 0 0 0 0 0 7.4973 -0.6066 -0.3385 C 0 0 0 0 0 -2.8526 2.2651 0.5452 C 0 0 0 0 0 -4.1178 2.6020 0.9898 C 0 0 0 0 0 -5.2299 2.2473 0.2483 C 0 0 0 0 0 -5.0818 1.5564 -0.9409 C 0 0 0 0 0 -3.8193 1.2223 -1.3946 C 0 0 0 0 0 -3.4796 -3.8102 1.3715 F 0 0 0 0 0 -4.3715 -2.7031 -0.4169 F 0 0 0 0 0 -3.1063 -4.5767 -0.7480 F 0 0 0 0 0 -0.8373 -3.0956 0.3479 N 0 0 0 0 0 2.6312 -0.7143 0.2362 N 0 0 0 0 0 1.3527 -2.8577 0.6470 O 0 0 0 0 0 1.4539 0.8599 -0.8017 O 0 0 0 0 0 8.6330 0.1050 -0.4810 O 0 0 0 0 0 7.5386 -1.8199 -0.3293 O 0 0 0 0 0 -1.0891 1.1405 -1.2210 S 0 0 0 0 0 -3.6348 0.3549 -2.8878 CL 0 0 0 0 0 -1.4567 2.7101 1.4772 CL 0 0 0 0 0 -3.0876 -0.9308 -0.8311 H 0 0 0 0 0 5.0577 -1.7229 -0.0351 H 0 0 0 0 0 7.0625 2.0584 -0.3160 H 0 0 0 0 0 4.9060 3.2139 -0.0728 H 0 0 0 0 0 2.8320 1.9197 0.1882 H 0 0 0 0 0 -4.2377 3.1408 1.9173 H 0 0 0 0 0 -6.2169 2.5080 0.5999 H 0 0 0 0 0 -5.9520 1.2823 -1.5170 H 0 0 0 0 0 2.6392 -1.5631 0.7044 H 0 0 0 0 0 9.4554 -0.3956 -0.5725 H 0 0 0 0 0 -0.8005 -4.0051 0.6829 H 0 0 0 0 0 18 19 2 0 0 0 18 17 1 0 0 0 19 20 1 0 0 0 17 16 2 0 0 0 20 31 1 0 0 0 20 1 2 0 0 0 23 8 1 0 0 0 16 1 1 0 0 0 16 32 1 0 0 0 1 30 1 0 0 0 21 8 1 0 0 0 8 22 1 0 0 0 8 6 1 0 0 0 7 6 2 0 0 0 7 2 1 0 0 0 6 24 1 0 0 0 30 2 1 0 0 0 2 3 2 0 0 0 24 5 1 0 0 0 3 5 1 0 0 0 3 4 1 0 0 0 5 26 2 0 0 0 27 4 2 0 0 0 4 25 1 0 0 0 25 9 1 0 0 0 9 14 2 0 0 0 9 10 1 0 0 0 14 13 1 0 0 0 10 11 2 0 0 0 13 12 2 0 0 0 11 12 1 0 0 0 11 15 1 0 0 0 15 29 2 0 0 0 15 28 1 0 0 0 7 33 1 0 0 0 10 34 1 0 0 0 12 35 1 0 0 0 13 36 1 0 0 0 14 37 1 0 0 0 17 38 1 0 0 0 18 39 1 0 0 0 19 40 1 0 0 0 25 41 1 0 0 0 28 42 1 0 0 0 24 43 1 0 0 0 M END $$$$