PUBCHEM-ZINC05159682 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 26 0 0 0 0 0 0 0 0999 V2000 -0.5160 1.4510 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -0.0280 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -0.6900 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -2.0540 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -2.7050 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -1.9750 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -0.6760 -1.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -2.7880 -2.7510 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -1.4240 -3.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -1.6230 -5.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -0.6220 -5.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 0.6470 -5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 0.8200 -3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -0.2250 -3.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 0.0460 2.4720 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6750 1.1840 2.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -0.4860 3.5140 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4210 2.0020 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 1.7230 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 1.7000 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -2.5950 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -3.7650 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -0.7900 -6.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 1.4830 -5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 1.7950 -3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END