PUBCHEM-ZINC05478920 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.0730 0.8310 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -0.4590 -0.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -0.5600 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 0.6600 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 1.5540 -0.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 2.9910 -0.7680 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1150 3.3000 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 3.4590 -2.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5370 2.8450 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 4.8530 -2.1140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1880 5.2270 -3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 4.6440 -1.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3330 4.2130 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 3.6370 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 5.8920 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 5.5940 0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 4.7670 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 5.7780 -1.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 5.2910 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 3.6110 -2.6810 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2920 0.9110 0.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -0.1660 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 -1.4570 0.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -1.7150 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -2.8610 0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2660 -0.1220 0.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 1.3000 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 6.2350 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 6.7060 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 0.7760 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 -0.9620 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 26 30 1 0 0 0 0 26 31 1 0 0 0 0 M CHG 1 20 -1 M END