PUBCHEM-ZINC05338036 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 -0.0020 1.4870 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 0.0860 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.6730 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 0.0510 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4610 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 2.1680 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 3.6360 -0.0930 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1280 4.2200 0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 4.2020 -0.3040 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6470 -0.6510 -0.4160 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6720 0.0380 -0.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -1.8920 -0.4800 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1280 -2.0600 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -2.8760 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -4.3560 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -5.2500 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 2.0190 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -0.4040 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 1.9970 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -2.5300 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -2.6320 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -2.6830 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -4.5990 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -4.5480 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -5.0770 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -5.1300 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -6.6690 0.4590 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2280 -7.3030 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -6.8740 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -6.9210 -0.4520 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 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 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 19 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 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 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 7 1 M CHG 1 9 -1 M CHG 1 10 1 M CHG 1 12 -1 M CHG 1 27 1 M END