PUBCHEM-ZINC05394861 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.2890 1.6390 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 0.2650 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -0.5220 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 0.0620 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 1.4350 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 2.2290 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 3.6170 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 4.2280 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 4.4690 1.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 3.6360 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 2.6670 1.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 4.0030 3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 5.5170 3.8170 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 5.5280 2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 6.6860 1.4370 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -1.9930 -0.3430 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5130 -2.5090 -0.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -2.6880 -0.4550 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1720 2.2530 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -0.1940 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -0.5560 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 1.8900 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 4.1770 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 3.5580 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 5.1750 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 3.2130 4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 4.2080 3.7880 H 0 0 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END