Amb17942876 OpenBabel05102515072D 26 27 0 0 1 0 0 0 0 0999 V2000 8.5564 -0.5000 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 4.5007 -4.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5032 -4.8461 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8122 -5.7971 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0032 -6.3849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5032 -7.2509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5032 -7.2509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1942 -5.7971 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5032 -4.8461 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5032 -3.8461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7961 -3.1390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5032 -3.8461 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2103 -3.1390 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9515 -2.1730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9856 -1.9142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6586 -1.4659 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3998 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6245 -1.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8834 -2.6907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8493 -2.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5564 -2.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2976 -1.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3316 -1.0176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2431 -6.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -5.4370 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0352 -7.0843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 6 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 6 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 1 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 23 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 M CHG 2 1 1 25 -1 M END > www.ambinter.com > Amb17942876 > 371.387 $$$$