COL Converted by convert_cif2sdf.py 2024/03/29 11:09:15 27 28 0 0 0 0 0 0 0 0999 V2000 3.7756 1.6597 0.3442 S 0 0 0 0 0 2.2709 2.4647 -0.2792 C 0 0 0 0 0 1.1386 1.4790 -0.2409 C 0 0 0 0 0 1.1707 0.1386 -0.1515 C 0 0 0 0 0 2.4453 -0.6870 -0.0598 C 0 0 0 0 0 3.6472 0.0966 -0.5722 C 0 0 0 0 0 -0.5877 1.8930 -0.3152 S 0 0 0 0 0 -1.2613 0.3022 -0.2286 C 0 0 0 0 0 -0.1405 -0.5073 -0.1405 C 0 0 0 0 0 -0.2657 -1.9629 -0.0446 C 0 0 0 0 0 -0.2940 -2.7134 -1.1640 O 0 0 0 0 0 -0.3444 -2.4954 1.0464 O 0 0 0 0 0 -2.5932 -0.0697 -0.2411 N 0 0 0 0 0 -3.5547 0.8692 -0.3269 C 0 0 0 0 0 -4.9924 0.4674 -0.3402 C 0 0 0 0 0 -5.9528 1.4055 -0.4270 O 0 0 0 0 0 -5.2949 -0.7043 -0.2706 O 0 0 0 0 0 -3.2523 2.0430 -0.3966 O 0 0 0 0 0 2.4334 2.7960 -1.3052 H 0 0 0 0 0 2.0297 3.3228 0.3478 H 0 0 0 0 0 2.3288 -1.5917 -0.6557 H 0 0 0 0 0 2.6175 -0.9648 0.9791 H 0 0 0 0 0 3.5192 0.3059 -1.6341 H 0 0 0 0 0 4.5548 -0.4892 -0.4227 H 0 0 0 0 0 -0.3755 -3.6750 -1.0999 H 0 0 0 0 0 -2.8348 -1.0077 -0.1849 H 0 0 0 0 0 -6.8843 1.1458 -0.4349 H 0 0 0 0 0 1 2 1 0 0 0 1 6 1 0 0 0 2 3 1 0 0 0 2 19 1 0 0 0 2 20 1 0 0 0 3 4 2 0 0 0 3 7 1 0 0 0 4 5 1 0 0 0 4 9 1 0 0 0 5 6 1 0 0 0 5 21 1 0 0 0 5 22 1 0 0 0 6 23 1 0 0 0 6 24 1 0 0 0 7 8 1 0 0 0 8 9 2 0 0 0 8 13 1 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 10 12 2 0 0 0 11 25 1 0 0 0 13 14 1 0 0 0 13 26 1 0 0 0 14 15 1 0 0 0 14 18 2 0 0 0 15 16 1 0 0 0 15 17 2 0 0 0 16 27 1 0 0 0 M END $$$$