PUBCHEM-ZINC05138416 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 1.0340 1.8480 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 0.3650 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -0.4780 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -1.9660 1.3010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0130 -2.0730 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -2.6940 2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -4.0470 -0.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3290 -4.3220 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -4.1830 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -2.6830 -2.2090 S 0 5 0 0 0 0 0 0 0 0 0 0 2.4000 -4.9200 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -4.2080 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 2.0490 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 2.4320 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 2.1990 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 0.2020 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 0.0720 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -0.3720 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -0.0680 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -2.6580 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -2.2330 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -3.7440 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -4.3140 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -5.1100 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -2.5680 -0.0050 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9490 -2.1240 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -2.5530 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -6.1560 0.0920 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 10 -1 M CHG 1 25 1 M CHG 1 28 -1 M END