JKA Converted by convert_cif2sdf.py 2024/03/29 11:09:15 32 33 0 0 0 0 0 0 0 0999 V2000 -0.0812 -0.5780 1.4091 C 0 0 0 0 0 1.4334 -1.0466 -1.0708 C 0 0 0 0 0 -3.9794 0.1921 0.1733 C 0 0 0 0 0 -2.9612 -0.5556 -1.1277 S 0 0 0 0 0 -3.0969 -1.9696 -1.1160 O 0 0 0 0 0 -3.0763 0.1815 -2.3366 O 0 0 0 0 0 -1.3950 -0.2895 -0.6326 N 0 0 0 0 0 -0.7022 0.9331 -1.0455 C 0 0 0 0 0 0.1067 1.5342 0.0971 C 0 0 0 0 0 0.9881 2.5387 -0.4096 O 0 0 0 0 0 0.8850 0.4841 0.8729 C 0 0 0 0 0 -0.7223 -1.2837 0.2123 C 0 0 0 0 0 0.3580 -2.0098 -0.5850 C 0 0 0 0 0 1.9797 -0.1837 0.0578 C 0 0 0 0 0 2.8728 0.7966 -0.4753 O 0 0 0 0 0 0.4695 -1.2983 2.0131 H 0 0 0 0 0 -0.8492 -0.0988 2.0134 H 0 0 0 0 0 2.2684 -1.6450 -1.4772 H 0 0 0 0 0 1.0638 -0.4345 -1.8863 H 0 0 0 0 0 -3.7662 -0.2918 1.1259 H 0 0 0 0 0 -3.7509 1.2556 0.2477 H 0 0 0 0 0 -5.0338 0.0639 -0.0712 H 0 0 0 0 0 -0.0759 0.7545 -1.9139 H 0 0 0 0 0 -1.4669 1.6696 -1.3513 H 0 0 0 0 0 -0.5936 2.0267 0.7916 H 0 0 0 0 0 0.5372 3.2707 -0.8519 H 0 0 0 0 0 1.3533 0.9755 1.7401 H 0 0 0 0 0 -1.4624 -2.0111 0.5752 H 0 0 0 0 0 -0.1008 -2.5058 -1.4472 H 0 0 0 0 0 0.8164 -2.7795 0.0446 H 0 0 0 0 0 2.5647 -0.8310 0.7321 H 0 0 0 0 0 3.6339 0.4235 -0.9422 H 0 0 0 0 0 6 4 2 0 0 0 8 7 1 0 0 0 8 9 1 0 0 0 7 4 1 0 0 0 7 12 1 0 0 0 4 5 2 0 0 0 4 3 1 0 0 0 2 13 1 0 0 0 2 14 1 0 0 0 15 14 1 0 0 0 13 12 1 0 0 0 10 9 1 0 0 0 9 11 1 0 0 0 14 11 1 0 0 0 12 1 1 0 0 0 11 1 1 0 0 0 1 16 1 0 0 0 1 17 1 0 0 0 2 18 1 0 0 0 2 19 1 0 0 0 3 20 1 0 0 0 3 21 1 0 0 0 3 22 1 0 0 0 8 23 1 0 0 0 8 24 1 0 0 0 9 25 1 0 0 0 10 26 1 0 0 0 11 27 1 0 0 0 12 28 1 0 0 0 13 29 1 0 0 0 13 30 1 0 0 0 14 31 1 0 0 0 15 32 1 0 0 0 M END $$$$