91F Converted by convert_cif2sdf.py 2024/03/29 11:09:15 31 33 0 0 0 0 0 0 0 0999 V2000 -2.5417 3.0169 -0.0022 O 0 0 0 0 0 -2.2218 1.8421 -0.0010 C 0 0 0 0 0 -0.9206 1.4693 -0.0009 N 0 0 0 0 0 -0.5804 0.1430 -0.0007 C 0 0 0 0 0 0.8514 -0.2151 0.0004 C 0 0 0 0 0 1.2358 -1.5597 0.0006 C 0 0 0 0 0 2.5720 -1.8913 0.0017 C 0 0 0 0 0 3.5397 -0.8893 0.0015 C 0 0 0 0 0 5.2481 -1.3184 0.0016 S 0 0 0 0 0 6.0740 0.2966 0.0013 C 0 0 0 0 0 3.1587 0.4499 0.0003 C 0 0 0 0 0 1.8242 0.7874 -0.0048 C 0 0 0 0 0 -1.4661 -0.8214 -0.0006 N 0 0 0 0 0 -2.7893 -0.5669 -0.0006 C 0 0 0 0 0 -3.2334 0.7758 0.0051 C 0 0 0 0 0 -3.7314 -1.5991 -0.0015 C 0 0 0 0 0 -5.0742 -1.2969 -0.0015 C 0 0 0 0 0 -5.5068 0.0232 -0.0028 C 0 0 0 0 0 -4.5976 1.0583 0.0101 C 0 0 0 0 0 -0.2252 2.1451 -0.0011 H 0 0 0 0 0 0.4861 -2.3368 0.0007 H 0 0 0 0 0 1.5304 1.8262 -0.0100 H 0 0 0 0 0 2.8698 -2.9296 0.0019 H 0 0 0 0 0 3.9112 1.2247 0.0002 H 0 0 0 0 0 5.7817 0.8551 0.8912 H 0 0 0 0 0 7.1545 0.1524 0.0014 H 0 0 0 0 0 5.7827 0.8547 -0.8888 H 0 0 0 0 0 -3.4075 -2.6294 -0.0013 H 0 0 0 0 0 -4.9403 2.0828 0.0099 H 0 0 0 0 0 -5.8013 -2.0959 -0.0014 H 0 0 0 0 0 -6.5647 0.2392 -0.0038 H 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 2 15 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 4 13 2 0 0 0 5 6 1 0 0 0 5 12 2 0 0 0 6 7 2 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 8 11 2 0 0 0 9 10 1 0 0 0 11 12 1 0 0 0 13 14 1 0 0 0 14 15 1 0 0 0 14 16 2 0 0 0 15 19 2 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 3 20 1 0 0 0 6 21 1 0 0 0 12 22 1 0 0 0 7 23 1 0 0 0 11 24 1 0 0 0 10 25 1 0 0 0 10 26 1 0 0 0 10 27 1 0 0 0 16 28 1 0 0 0 19 29 1 0 0 0 17 30 1 0 0 0 18 31 1 0 0 0 M END $$$$