9DU Converted by convert_cif2sdf.py 2024/03/29 11:09:15 29 29 0 0 0 0 0 0 0 0999 V2000 -3.2096 -1.1090 -0.3735 C 0 0 0 0 0 -4.4370 -0.7299 -0.8833 C 0 0 0 0 0 -5.0058 0.4691 -0.4959 C 0 0 0 0 0 -4.3473 1.2891 0.4012 C 0 0 0 0 0 -3.1199 0.9084 0.9122 C 0 0 0 0 0 -2.5511 -0.2898 0.5242 C 0 0 0 0 0 -1.2152 -0.7068 1.0843 C 0 0 0 0 0 -0.1450 -0.2067 0.2182 N 0 0 0 0 0 1.1428 -0.4606 0.5237 C 0 0 0 0 0 1.4159 -1.1016 1.5167 O 0 0 0 0 0 2.2439 0.0536 -0.3668 C 0 0 0 0 0 2.1744 1.5807 -0.4355 C 0 0 0 0 0 3.6002 -0.3700 0.2020 C 0 0 0 0 0 4.9175 0.1209 -0.9451 S 0 0 0 0 0 -2.7681 -2.0473 -0.6732 H 0 0 0 0 0 -4.9524 -1.3702 -1.5848 H 0 0 0 0 0 -5.9646 0.7667 -0.8948 H 0 0 0 0 0 -4.7907 2.2256 0.7036 H 0 0 0 0 0 -2.6045 1.5489 1.6123 H 0 0 0 0 0 -1.0963 -0.2923 2.0857 H 0 0 0 0 0 -1.1655 -1.7947 1.1326 H 0 0 0 0 0 -0.3627 0.3062 -0.5761 H 0 0 0 0 0 2.1250 -0.3609 -1.3682 H 0 0 0 0 0 2.2933 1.9952 0.5659 H 0 0 0 0 0 2.9708 1.9519 -1.0794 H 0 0 0 0 0 1.2083 1.8822 -0.8406 H 0 0 0 0 0 3.7576 0.1165 1.1646 H 0 0 0 0 0 3.6172 -1.4511 0.3340 H 0 0 0 0 0 6.0319 -0.3072 -0.3263 H 0 0 0 0 0 3 2 2 0 0 0 3 4 1 0 0 0 2 1 1 0 0 0 4 5 2 0 0 0 1 6 2 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 9 10 2 0 0 0 9 11 1 0 0 0 14 13 1 0 0 0 13 11 1 0 0 0 11 12 1 0 0 0 1 15 1 0 0 0 2 16 1 0 0 0 3 17 1 0 0 0 4 18 1 0 0 0 5 19 1 0 0 0 7 20 1 0 0 0 7 21 1 0 0 0 8 22 1 0 0 0 11 23 1 0 0 0 12 24 1 0 0 0 12 25 1 0 0 0 12 26 1 0 0 0 13 27 1 0 0 0 13 28 1 0 0 0 14 29 1 0 0 0 M END $$$$