JW8 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 28 29 0 0 0 0 0 0 0 0999 V2000 -0.0086 0.4612 1.0472 C 0 0 0 0 0 0.6392 1.6623 0.8158 C 0 0 0 0 0 1.9356 1.6704 0.3443 C 0 0 0 0 0 2.5938 0.4665 0.1016 C 0 0 0 0 0 1.9373 -0.7406 0.3361 C 0 0 0 0 0 0.6408 -0.7367 0.8068 C 0 0 0 0 0 4.0690 0.4692 -0.4356 B 0 0 0 0 0 4.7351 1.7004 -0.6742 O 0 0 0 0 0 4.7378 -0.7587 -0.6820 O 0 0 0 0 0 -1.6619 0.4579 1.6550 S 0 0 0 0 0 -2.6679 0.4657 0.3404 N 0 0 0 0 0 -3.2915 1.5240 -0.4789 C 0 0 0 0 0 -3.3484 0.4741 -1.6028 C 0 0 0 0 0 -3.2972 -0.5820 -0.4878 C 0 0 0 0 0 -1.8503 -0.7960 2.2978 O 0 0 0 0 0 -1.8501 1.7040 2.3127 O 0 0 0 0 0 0.1284 2.5947 1.0053 H 0 0 0 0 0 2.4392 2.6091 0.1640 H 0 0 0 0 0 2.4425 -1.6770 0.1494 H 0 0 0 0 0 0.1305 -1.6714 0.9900 H 0 0 0 0 0 5.6390 1.6013 -1.0038 H 0 0 0 0 0 5.6407 -0.6558 -1.0113 H 0 0 0 0 0 -4.2710 1.8348 -0.1175 H 0 0 0 0 0 -2.6301 2.3629 -0.6948 H 0 0 0 0 0 -4.2850 0.4797 -2.1619 H 0 0 0 0 0 -2.4689 0.4703 -2.2460 H 0 0 0 0 0 -2.6372 -1.4212 -0.7086 H 0 0 0 0 0 -4.2789 -0.8932 -0.1309 H 0 0 0 0 0 12 13 1 0 0 0 12 11 1 0 0 0 15 10 2 0 0 0 13 14 1 0 0 0 11 10 1 0 0 0 11 14 1 0 0 0 6 5 2 0 0 0 6 1 1 0 0 0 10 1 1 0 0 0 10 16 2 0 0 0 5 4 1 0 0 0 1 2 2 0 0 0 9 7 1 0 0 0 4 7 1 0 0 0 4 3 2 0 0 0 2 3 1 0 0 0 7 8 1 0 0 0 2 17 1 0 0 0 3 18 1 0 0 0 5 19 1 0 0 0 6 20 1 0 0 0 8 21 1 0 0 0 9 22 1 0 0 0 12 23 1 0 0 0 12 24 1 0 0 0 13 25 1 0 0 0 13 26 1 0 0 0 14 27 1 0 0 0 14 28 1 0 0 0 M END $$$$