PUBCHEM-ZINC05963859 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 1 0 0 0 0 0999 V2000 -0.4210 0.9630 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -0.3120 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -0.9610 1.1910 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6580 -0.1690 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -2.3210 1.4330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5270 -3.3470 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -1.5670 -0.2450 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -2.2900 2.1850 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4780 -1.2370 2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -3.0030 3.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -4.1490 3.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -2.9340 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -4.3220 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -2.9970 2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -2.0790 0.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -2.0200 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -2.9460 1.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 0.0190 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 1.7360 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 1.3820 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 0.7960 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -5.0740 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 -4.6630 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 -4.3110 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 -2.0130 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5860 -3.2780 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5800 -3.7210 3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 -1.8470 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 0.6630 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -0.8730 -1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 0.5570 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -1.5590 2.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -2.2590 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -2.3750 4.5390 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9710 -1.8030 -0.1000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 3 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 34 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 13 22 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 34 -1 M CHG 1 35 -1 M END