F7T Converted by convert_cif2sdf.py 2024/03/29 11:09:15 40 43 0 0 0 0 0 0 0 0999 V2000 2.2193 3.1540 -2.2139 O 0 0 0 0 0 2.5631 1.9892 -1.4774 S 0 0 0 0 0 2.7863 0.7479 -2.1318 O 0 0 0 0 0 3.9059 2.3273 -0.8455 O 0 0 0 0 0 1.4420 1.7739 -0.0675 C 0 0 0 0 0 0.0421 1.4262 -0.5777 C 0 0 0 0 0 -0.9035 1.2434 0.6114 C 0 0 0 0 0 -2.2437 0.9117 0.1221 N 0 0 0 0 0 -3.2647 1.8099 -0.0644 C 0 0 0 0 0 -3.3855 3.1818 0.1181 C 0 0 0 0 0 -4.5778 3.8111 -0.1671 C 0 0 0 0 0 -5.6606 3.0805 -0.6357 C 0 0 0 0 0 -5.5639 1.7317 -0.8220 C 0 0 0 0 0 -4.3625 1.0658 -0.5404 C 0 0 0 0 0 -3.9547 -0.1917 -0.6098 N 0 3 0 0 0 -2.6803 -0.3719 -0.2318 C 0 0 0 0 0 -1.9367 -1.6758 -0.2096 C 0 0 0 0 0 -2.4478 -2.8810 -0.5752 N 0 3 0 0 0 -1.8515 -4.0178 -0.5717 C 0 0 0 0 0 -0.5266 -4.1155 -0.1594 C 0 0 0 0 0 0.0985 -2.9427 0.2383 C 0 0 0 0 0 -0.5817 -1.7519 0.2160 C 0 0 0 0 0 -4.3951 -2.2101 -1.0778 PT 0 0 0 0 0 -6.0719 -3.1158 0.3144 CL 0 0 0 0 0 1.8083 0.9666 0.5678 H 0 0 0 0 0 1.3997 2.6985 0.5079 H 0 0 0 0 0 -0.3236 2.2327 -1.2131 H 0 0 0 0 0 0.0844 0.5017 -1.1532 H 0 0 0 0 0 -0.5378 0.4370 1.2458 H 0 0 0 0 0 -0.9463 2.1688 1.1869 H 0 0 0 0 0 -2.5454 3.7540 0.4834 H 0 0 0 0 0 -4.6693 4.8772 -0.0253 H 0 0 0 0 0 -6.5898 3.5839 -0.8558 H 0 0 0 0 0 -6.4147 1.1765 -1.1879 H 0 0 0 0 0 -2.3825 -4.9025 -0.8899 H 0 0 0 0 0 -0.0075 -5.0633 -0.1486 H 0 0 0 0 0 1.1274 -2.9670 0.5663 H 0 0 0 0 0 -0.0764 -0.8510 0.5290 H 0 0 0 0 0 -4.8765 -2.5232 -3.3677 CL 0 0 0 0 0 4.6162 2.4729 -1.4862 H 0 0 0 0 0 1 2 2 0 0 0 2 3 2 0 0 0 2 4 1 0 0 0 2 5 1 0 0 0 5 6 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 8 16 1 0 0 0 9 10 2 0 0 0 9 14 1 0 0 0 10 11 1 0 0 0 11 12 2 0 0 0 12 13 1 0 0 0 13 14 2 0 0 0 14 15 1 0 0 0 15 16 2 0 0 0 15 23 1 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 17 22 1 0 0 0 18 19 1 0 0 0 18 23 1 0 0 0 19 20 2 0 0 0 20 21 1 0 0 0 21 22 2 0 0 0 23 24 1 0 0 0 5 25 1 0 0 0 5 26 1 0 0 0 6 27 1 0 0 0 6 28 1 0 0 0 7 29 1 0 0 0 7 30 1 0 0 0 10 31 1 0 0 0 11 32 1 0 0 0 12 33 1 0 0 0 13 34 1 0 0 0 19 35 1 0 0 0 20 36 1 0 0 0 21 37 1 0 0 0 22 38 1 0 0 0 23 39 1 0 0 0 4 40 1 0 0 0 M END $$$$