PUBCHEM-ZINC05138802 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 26 0 0 1 0 0 0 0 0999 V2000 -0.5010 1.4580 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 0.0100 -0.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5810 -0.0130 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.8500 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -0.4120 -2.0350 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -1.3060 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.5940 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -1.3390 1.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -0.2530 1.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 0.4670 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 0.0190 0.9750 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 -0.2600 2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -0.6340 2.6840 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3830 -1.7160 2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 0.0920 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 1.2440 3.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 2.0480 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 1.9580 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 1.4990 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -1.9080 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -0.7580 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 0.2070 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 1.5410 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 -1.0650 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 0.6550 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -0.5430 5.0190 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 M CHG 1 26 -1 M END