PUBCHEM-ZINC05113824 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 25 0 0 1 0 0 0 0 0999 V2000 -0.0110 1.5580 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 0.0350 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -0.5290 -0.2530 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -2.3360 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -3.1330 -0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3420 -2.7670 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -4.6110 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 -5.4060 -0.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -3.1280 -1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 2.0460 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0740 1.6170 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 3.5920 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 3.9410 0.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 2.0100 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.9080 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -0.2960 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -0.4370 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -2.5830 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -2.5450 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7620 -4.1030 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -4.8250 1.1160 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0870 4.2310 -1.0080 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0150 1.6130 1.3110 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4070 2.5620 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 0.9520 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 1.3470 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 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 21 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 22 -1 M CHG 1 23 1 M END