PUBCHEM-ZINC05409225 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 0.5180 1.4990 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 0.2460 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -0.7900 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -0.5370 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 0.6980 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 1.7050 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 3.0060 1.2290 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5060 3.6250 1.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 3.4150 1.5810 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8280 -1.7390 0.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -1.9740 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -2.6630 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.0980 -1.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -4.0820 -0.3030 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7730 -4.1270 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 -4.7170 1.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7580 -4.4680 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 -4.3470 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 -5.3690 2.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -6.1620 0.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -4.8760 -1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 2.2970 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 0.0620 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 0.8440 1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 -6.4370 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -5.7710 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 -3.1270 1.9930 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 2 0 0 0 0 18 27 1 0 0 0 0 20 25 1 0 0 0 0 21 26 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 27 -1 M END