PUBCHEM-ZINC05113962 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 30 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.4780 -1.2070 N 0 5 0 0 0 0 0 0 0 0 0 0 0.7290 -1.9460 -1.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2890 -2.3360 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -2.4000 -2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -1.7770 -3.9740 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -2.4640 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 -1.6890 0.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 3.4670 1.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8550 3.8570 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 3.9220 2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 3.2960 1.3880 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 3.9870 1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 3.2140 2.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -2.0100 -2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -3.4900 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 3.5320 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 5.0110 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -3.7850 0.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 2.0000 1.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 1.6110 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 5.3090 2.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 5.5940 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 -4.0690 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 3.7640 2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -2.2450 -4.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 25 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 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 3 -1 M END