PUBCHEM-ZINC03872821 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 29 0 0 1 0 0 0 0 0999 V2000 0.5650 1.2530 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.2160 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -0.5130 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -2.7060 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -2.1860 2.2850 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2690 -2.7470 3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -1.2250 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -4.0170 0.8730 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -4.4630 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -4.6010 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 1.4960 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 2.8820 -0.7530 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9730 3.1280 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 3.0390 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 4.0540 -0.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 1.5220 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 1.8960 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -0.8610 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.4820 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -0.0170 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -0.1450 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 1.3300 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 0.7430 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -1.9650 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -2.4380 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 2.2330 -1.6470 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0470 3.9540 0.2350 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0020 4.4360 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 3.6210 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 4.6500 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 24 25 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 M CHG 1 5 1 M CHG 1 26 -1 M CHG 1 27 1 M END