PUBCHEM-ZINC05650268 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.0110 1.1470 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.2400 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -0.8530 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -0.0250 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 1.3660 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 1.9590 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 1.8790 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 0.7890 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -0.3460 0.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 -1.2860 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 3.3160 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 3.9330 1.6140 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0720 3.3270 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 5.2970 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 6.2610 1.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 4.1190 2.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 5.0230 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 3.1980 3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 2.1670 3.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 3.5160 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 2.9180 5.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 3.1670 5.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 4.0160 5.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 4.6100 3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 4.3540 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 4.2790 5.6240 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8060 3.6540 6.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 5.1170 5.0800 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9660 1.6040 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -0.8540 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -1.9320 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 3.0390 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 0.7310 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0920 3.3750 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 3.8990 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 2.2540 5.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 2.6940 6.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 5.2650 3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 4.8030 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2950 5.2800 1.1060 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M CHG 1 40 -1 M END