PUBCHEM-ZINC05828981 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 20 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5890 -1.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -2.3940 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -3.0470 -2.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0100 -2.6770 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -4.5430 -2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -5.2320 -2.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -2.7160 -2.5110 N 0 5 0 0 0 0 0 0 0 0 0 0 3.3320 -3.0480 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -2.6950 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -2.7110 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 1.6250 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -5.1080 -2.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 2.0000 1.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 3.0080 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -6.0710 -2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 17 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 9 -1 M END