99R Converted by convert_cif2sdf.py 2024/03/29 11:09:15 46 49 0 0 0 0 0 0 0 0999 V2000 -1.3172 3.0715 0.6265 C 0 0 0 0 0 2.8916 -1.8947 -0.0591 C 0 0 0 0 0 2.8155 -1.1184 -1.3774 C 0 0 0 0 0 3.7336 0.1040 -1.2996 C 0 0 0 0 0 3.3481 0.2703 1.1650 C 0 0 0 0 0 -1.6950 0.7299 0.6196 C 0 0 0 0 0 -2.6382 -0.2269 0.2579 C 0 0 0 0 0 -3.7247 0.4569 -0.2733 N 0 0 0 0 0 -3.4841 1.7956 -0.2759 C 0 0 0 0 0 -0.4546 0.4558 1.1951 C 0 0 0 0 0 -0.1404 -0.8939 1.4245 C 0 0 0 0 0 -1.0583 -1.8459 1.0728 C 0 0 0 0 0 -2.2932 -1.5442 0.4993 C 0 0 0 0 0 -2.1586 2.0185 0.3152 C 0 0 0 0 0 -0.0751 2.8162 1.2071 C 0 0 0 0 0 0.3711 1.5534 1.4951 C 0 0 0 0 0 -4.2416 2.6580 -0.6780 O 0 0 0 0 0 -4.9449 -0.1742 -0.7812 C 0 0 0 0 0 1.4004 -1.3507 2.1462 S 0 0 0 0 0 1.5966 -0.4844 3.2559 O 0 0 0 0 0 1.3870 -2.7672 2.2587 O 0 0 0 0 0 2.5843 -0.9798 1.0495 N 0 0 0 0 0 -5.9592 -0.3094 0.3556 C 0 0 0 0 0 3.2648 1.0239 -0.1700 C 0 0 0 0 0 4.1264 2.2122 -0.1154 N 0 0 0 0 0 -1.6188 4.0875 0.4158 H 0 0 0 0 0 2.1670 -2.7086 -0.0723 H 0 0 0 0 0 3.8952 -2.3001 0.0695 H 0 0 0 0 0 3.1360 -1.7621 -2.1976 H 0 0 0 0 0 1.7897 -0.7928 -1.5498 H 0 0 0 0 0 4.7550 -0.2211 -1.1032 H 0 0 0 0 0 3.6998 0.6438 -2.2459 H 0 0 0 0 0 2.9243 0.8846 1.9603 H 0 0 0 0 0 4.3889 0.0433 1.3942 H 0 0 0 0 0 -0.8149 -2.8833 1.2493 H 0 0 0 0 0 -2.9781 -2.3383 0.2438 H 0 0 0 0 0 0.5654 3.6540 1.4409 H 0 0 0 0 0 1.3409 1.4039 1.9455 H 0 0 0 0 0 -5.3684 0.4401 -1.5744 H 0 0 0 0 0 -4.7063 -1.1625 -1.1739 H 0 0 0 0 0 -6.8678 -0.7790 -0.0210 H 0 0 0 0 0 -5.5359 -0.9242 1.1501 H 0 0 0 0 0 -6.1990 0.6786 0.7495 H 0 0 0 0 0 2.2346 1.3294 -0.3534 H 0 0 0 0 0 4.0930 2.7237 -0.9847 H 0 0 0 0 0 3.8781 2.8047 0.6624 H 0 0 0 0 0 25 24 1 0 0 0 4 24 1 0 0 0 4 3 1 0 0 0 24 5 1 0 0 0 3 2 1 0 0 0 5 22 1 0 0 0 22 2 1 0 0 0 22 19 1 0 0 0 21 19 2 0 0 0 15 16 2 0 0 0 15 1 1 0 0 0 16 10 1 0 0 0 19 20 2 0 0 0 19 11 1 0 0 0 1 14 2 0 0 0 10 11 2 0 0 0 10 6 1 0 0 0 11 12 1 0 0 0 14 6 1 0 0 0 14 9 1 0 0 0 6 7 2 0 0 0 12 13 2 0 0 0 7 13 1 0 0 0 7 8 1 0 0 0 9 17 2 0 0 0 9 8 1 0 0 0 8 18 1 0 0 0 23 18 1 0 0 0 1 26 1 0 0 0 2 27 1 0 0 0 2 28 1 0 0 0 3 29 1 0 0 0 3 30 1 0 0 0 4 31 1 0 0 0 4 32 1 0 0 0 5 33 1 0 0 0 5 34 1 0 0 0 12 35 1 0 0 0 13 36 1 0 0 0 15 37 1 0 0 0 16 38 1 0 0 0 18 39 1 0 0 0 18 40 1 0 0 0 23 41 1 0 0 0 23 42 1 0 0 0 23 43 1 0 0 0 24 44 1 0 0 0 25 45 1 0 0 0 25 46 1 0 0 0 M END $$$$