F3W Converted by convert_cif2sdf.py 2024/03/29 11:09:15 49 53 0 0 0 0 0 0 0 0999 V2000 1.4029 3.4202 0.0037 C 0 0 0 0 0 3.8296 0.0310 -0.1019 C 0 0 0 0 0 4.9989 0.6816 0.0056 C 0 0 0 0 0 4.7732 2.0292 0.0907 N 0 0 0 0 0 -0.7964 0.6370 -0.3070 C 0 0 0 0 0 -2.0957 -0.0602 -0.4247 C 0 0 0 0 0 0.4290 0.0243 -0.2841 N 0 0 0 0 0 -3.2671 0.5749 -0.0243 C 0 0 0 0 0 -4.4888 -0.0903 -0.1390 C 0 0 0 0 0 -4.5272 -1.3899 -0.6554 C 0 0 0 0 0 -3.3603 -2.0123 -1.0506 C 0 0 0 0 0 -0.6428 1.9347 -0.2077 N 0 0 0 0 0 -5.7345 0.5740 0.2818 C 0 0 0 0 0 -6.9132 -0.0710 0.1695 C 0 0 0 0 0 -8.1230 0.5741 0.5796 C 0 0 0 0 0 -9.0841 1.0863 0.9045 N 0 0 0 0 0 -2.1493 -1.3556 -0.9437 C 0 0 0 0 0 0.6767 2.2286 -0.1172 C 0 0 0 0 0 2.7144 3.4114 0.0723 N 0 0 0 0 0 1.3760 1.0099 -0.1654 C 0 0 0 0 0 2.7756 1.0446 -0.0880 C 0 0 0 0 0 3.4233 2.2853 0.0365 C 0 0 0 0 0 0.6814 -1.4160 -0.3703 C 0 0 0 0 0 2.1886 -1.6741 -0.3197 C 0 0 0 0 0 2.4522 -3.1779 -0.4105 C 0 0 0 0 0 1.7740 -3.8865 0.7644 C 0 0 0 0 0 0.2668 -3.6285 0.7138 C 0 0 0 0 0 0.0032 -2.1246 0.8036 C 0 0 0 0 0 0.8766 4.3624 0.0371 H 0 0 0 0 0 3.6925 -1.0377 -0.1859 H 0 0 0 0 0 5.9715 0.2123 0.0238 H 0 0 0 0 0 5.4652 2.7037 0.1746 H 0 0 0 0 0 -3.2316 1.5790 0.3741 H 0 0 0 0 0 -5.4705 -1.9090 -0.7419 H 0 0 0 0 0 -3.3948 -3.0153 -1.4480 H 0 0 0 0 0 -5.7030 1.5768 0.6802 H 0 0 0 0 0 -6.9437 -1.0738 -0.2290 H 0 0 0 0 0 -1.2400 -1.8496 -1.2546 H 0 0 0 0 0 0.2788 -1.7998 -1.3082 H 0 0 0 0 0 2.6726 -1.1693 -1.1566 H 0 0 0 0 0 2.5912 -1.2903 0.6172 H 0 0 0 0 0 2.0496 -3.5617 -1.3475 H 0 0 0 0 0 3.5257 -3.3618 -0.3741 H 0 0 0 0 0 1.9618 -4.9578 0.6998 H 0 0 0 0 0 2.1766 -3.5027 1.7013 H 0 0 0 0 0 -0.1359 -4.0122 -0.2241 H 0 0 0 0 0 -0.2162 -4.1332 1.5497 H 0 0 0 0 0 0.4058 -1.7408 1.7406 H 0 0 0 0 0 -1.0704 -1.9407 0.7672 H 0 0 0 0 0 16 15 3 0 0 0 15 14 1 0 0 0 14 13 2 0 0 0 10 11 2 0 0 0 10 9 1 0 0 0 11 17 1 0 0 0 13 9 1 0 0 0 9 8 2 0 0 0 17 6 2 0 0 0 8 6 1 0 0 0 6 5 1 0 0 0 27 28 1 0 0 0 27 26 1 0 0 0 28 23 1 0 0 0 5 7 1 0 0 0 5 12 2 0 0 0 23 7 1 0 0 0 23 24 1 0 0 0 26 25 1 0 0 0 7 20 1 0 0 0 12 18 1 0 0 0 25 24 1 0 0 0 20 18 2 0 0 0 20 21 1 0 0 0 18 1 1 0 0 0 21 2 1 0 0 0 21 22 2 0 0 0 1 19 2 0 0 0 2 3 2 0 0 0 22 19 1 0 0 0 22 4 1 0 0 0 3 4 1 0 0 0 1 29 1 0 0 0 2 30 1 0 0 0 3 31 1 0 0 0 4 32 1 0 0 0 8 33 1 0 0 0 10 34 1 0 0 0 11 35 1 0 0 0 13 36 1 0 0 0 14 37 1 0 0 0 17 38 1 0 0 0 23 39 1 0 0 0 24 40 1 0 0 0 24 41 1 0 0 0 25 42 1 0 0 0 25 43 1 0 0 0 26 44 1 0 0 0 26 45 1 0 0 0 27 46 1 0 0 0 27 47 1 0 0 0 28 48 1 0 0 0 28 49 1 0 0 0 M END $$$$