CUG Converted by convert_cif2sdf.py 2024/03/29 11:09:15 45 46 0 0 0 0 0 0 0 0999 V2000 -1.0175 -0.5879 -0.4793 N 0 0 0 0 0 -0.1817 -1.7884 -0.4107 C 0 0 0 0 0 -0.4245 -2.6412 -1.6294 C 0 0 0 0 0 -1.2156 -2.2821 -2.4691 O 0 0 0 0 0 1.2930 -1.3814 -0.3591 C 0 0 0 0 0 -2.8289 3.9566 -1.3273 C 0 0 0 0 0 -5.3122 1.6428 0.4323 C 0 0 0 0 0 4.7277 1.3379 0.4606 C 0 0 0 0 0 3.4103 0.1538 -1.3984 C 0 0 0 0 0 3.0597 0.5631 2.3784 C 0 0 0 0 0 -2.2894 -0.6259 -0.0327 C 0 0 0 0 0 3.5438 0.4975 0.0574 C 0 0 0 0 0 -3.1348 0.5885 -0.1030 C 0 0 0 0 0 2.7189 0.1278 1.0110 C 0 0 0 0 0 -6.3319 -0.4914 1.2206 C 0 0 0 0 0 -4.5302 0.5471 0.3867 C 0 0 0 0 0 -7.0916 -1.5465 1.6990 N 0 0 0 0 0 -2.6497 1.6933 -0.5956 N 0 0 0 0 0 -5.1033 -0.5777 0.8149 N 0 0 0 0 0 1.5611 -0.6277 0.8747 N 0 0 0 0 0 5.9354 0.6505 0.1251 O 0 0 0 0 0 3.9205 -0.1597 3.1209 O 0 0 0 0 0 -2.7411 -1.6563 0.4262 O 0 0 0 0 0 2.5648 1.5755 2.8343 O 0 0 0 0 0 -3.4927 2.8155 -0.7800 O 0 0 0 0 0 1.6819 -0.2815 -1.7591 S 0 0 0 0 0 -6.8853 1.1732 1.0718 S 0 0 0 0 0 -0.6555 0.2352 -0.8421 H 0 0 0 0 0 -0.4329 -2.3558 0.4857 H 0 0 0 0 0 1.9243 -2.2688 -0.3979 H 0 0 0 0 0 -2.4128 3.7028 -2.3027 H 0 0 0 0 0 -3.5428 4.7741 -1.4386 H 0 0 0 0 0 -2.0251 4.2645 -0.6586 H 0 0 0 0 0 -5.0232 2.6399 0.1331 H 0 0 0 0 0 4.6936 2.2906 -0.0668 H 0 0 0 0 0 4.6987 1.5159 1.5353 H 0 0 0 0 0 3.7015 1.0131 -2.0020 H 0 0 0 0 0 4.0559 -0.6918 -1.6327 H 0 0 0 0 0 -6.7080 -2.4362 1.7488 H 0 0 0 0 0 -8.0064 -1.3948 1.9833 H 0 0 0 0 0 0.9210 -0.6582 1.6024 H 0 0 0 0 0 6.7383 1.0979 0.4238 H 0 0 0 0 0 4.1134 0.1654 4.0109 H 0 0 0 0 0 0.2371 -3.7984 -1.7822 O 0 0 0 0 0 0.0473 -4.3107 -2.5797 H 0 0 0 0 0 9 12 1 0 0 0 9 26 1 0 0 0 8 12 1 0 0 0 8 21 1 0 0 0 12 14 2 0 0 0 23 11 2 0 0 0 26 5 1 0 0 0 20 5 1 0 0 0 20 14 1 0 0 0 5 2 1 0 0 0 14 10 1 0 0 0 24 10 2 0 0 0 11 1 1 0 0 0 11 13 1 0 0 0 1 2 1 0 0 0 10 22 1 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 13 18 2 0 0 0 13 16 1 0 0 0 18 25 1 0 0 0 7 16 2 0 0 0 7 27 1 0 0 0 16 19 1 0 0 0 6 25 1 0 0 0 27 15 1 0 0 0 19 15 2 0 0 0 15 17 1 0 0 0 1 28 1 0 0 0 2 29 1 0 0 0 5 30 1 0 0 0 6 31 1 0 0 0 6 32 1 0 0 0 6 33 1 0 0 0 7 34 1 0 0 0 8 35 1 0 0 0 8 36 1 0 0 0 9 37 1 0 0 0 9 38 1 0 0 0 17 39 1 0 0 0 17 40 1 0 0 0 20 41 1 0 0 0 21 42 1 0 0 0 22 43 1 0 0 0 3 44 1 0 0 0 44 45 1 0 0 0 M END $$$$