PUBCHEM-ZINC06411533 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 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 0 0 0 0 0 0 0 0 0 0 1.3960 -4.5690 -2.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8250 -4.8630 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -5.2110 -3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -5.6510 -4.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -5.0080 -2.4470 N 0 5 0 0 0 0 0 0 0 0 0 0 -0.4240 -4.7480 -3.3270 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 1.8770 0.9070 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 0.9530 -2.7460 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -2.7300 -2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -5.2940 -3.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 -5.7140 -4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 10 -1 M END