94V Converted by convert_cif2sdf.py 2024/03/29 11:09:15 27 28 0 0 0 0 0 0 0 0999 V2000 -6.3595 -1.3789 0.5790 C 0 0 0 0 0 -2.1919 0.7977 -0.1630 C 0 0 0 0 0 -4.3435 0.0326 0.4742 C 0 0 0 0 0 -5.3963 -1.7970 -0.2458 C 0 0 0 0 0 1.1145 -1.1467 -0.9892 C 0 0 0 0 0 0.9493 -0.0273 -0.1967 C 0 0 0 0 0 1.3462 -0.0526 1.1282 C 0 0 0 0 0 1.6769 -2.2928 -0.4586 C 0 0 0 0 0 1.9088 -1.1997 1.6588 C 0 0 0 0 0 2.0795 -2.3170 0.8638 C 0 0 0 0 0 -4.3290 -1.0210 -0.2805 N 0 0 0 0 0 -3.3123 0.9602 0.5677 N 0 0 0 0 0 -1.1921 1.6975 -0.0734 N 0 0 0 0 0 -2.0826 -0.1615 -0.9030 O 0 0 0 0 0 1.0964 2.5057 -0.5190 O 0 0 0 0 0 -0.1120 1.1259 -2.2173 O 0 0 0 0 0 -5.8156 0.1142 1.3405 S 0 0 0 0 0 0.2330 1.4335 -0.8732 S 0 0 0 0 0 -8.0194 -2.2345 0.8726 BR 0 0 0 0 0 1.1402 1.3540 2.1250 CL 0 0 0 0 0 -5.4844 -2.6967 -0.8364 H 0 0 0 0 0 0.8007 -1.1280 -2.0228 H 0 0 0 0 0 1.8013 -3.1693 -1.0774 H 0 0 0 0 0 2.2200 -1.2201 2.6928 H 0 0 0 0 0 2.5180 -3.2133 1.2779 H 0 0 0 0 0 -3.3999 1.7251 1.1573 H 0 0 0 0 0 -1.3084 2.4988 0.4607 H 0 0 0 0 0 20 7 1 0 0 0 11 4 1 0 0 0 11 3 2 0 0 0 12 3 1 0 0 0 12 2 1 0 0 0 7 9 2 0 0 0 7 6 1 0 0 0 9 10 1 0 0 0 4 1 2 0 0 0 13 2 1 0 0 0 13 18 1 0 0 0 3 17 1 0 0 0 16 18 2 0 0 0 2 14 2 0 0 0 6 18 1 0 0 0 6 5 2 0 0 0 18 15 2 0 0 0 10 8 2 0 0 0 1 17 1 0 0 0 1 19 1 0 0 0 5 8 1 0 0 0 4 21 1 0 0 0 5 22 1 0 0 0 8 23 1 0 0 0 9 24 1 0 0 0 10 25 1 0 0 0 12 26 1 0 0 0 13 27 1 0 0 0 M END $$$$