PUBCHEM-ZINC05019144 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.0300 1.0320 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.2000 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -0.5580 -0.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 0.4000 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 1.7610 0.7210 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 0.4380 -0.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 1.2370 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 -0.5860 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -1.6710 -1.4980 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3740 -1.7040 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 -2.4450 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 -0.5260 -1.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 -1.2770 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 0.2610 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -1.1430 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -0.8240 -1.6940 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 -2.1430 -1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 -2.1030 -2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -3.1780 -2.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8530 -4.0310 -2.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 1.5260 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -2.1740 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -1.0270 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -3.1100 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 -2.0060 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5830 -1.1370 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -2.2240 -3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 19 20 3 0 0 0 0 M CHG 1 9 1 M END