PUBCHEM-ZINC02027571 MOE2007 3D CORINA 3.40 0006 02.08.2006 16 16 0 0 0 0 0 0 0 0999 V2000 -0.1990 0.7070 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.5260 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -0.8680 0.5350 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 0.0680 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 1.3280 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 1.6710 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 3.2370 -1.4480 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 3.9700 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 4.4640 0.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.4470 0.1200 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 2.6340 -1.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 3.6000 0.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 0.9020 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -1.2950 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -0.2470 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 1.7000 0.9180 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 13 1 0 0 0 0 2 3 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 3 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 16 1 0 0 0 0 M CHG 1 16 -1 M END