PUBCHEM-ZINC05167349 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 -0.3390 1.4720 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -0.0080 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -0.5090 0.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -0.7040 -0.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -0.2430 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -2.1560 -1.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2480 -2.6530 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -2.5270 -2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -2.1350 -2.3260 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 -2.6710 -4.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -2.3750 -4.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5660 -1.3100 -4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 -2.7700 -5.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3730 -2.1620 -6.0840 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 -3.1340 -3.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 -2.9340 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -2.7200 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -1.8600 -1.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 1.6910 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 1.8140 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 2.0090 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -1.9890 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -3.6010 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -2.1390 -4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -3.7460 -4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -2.3450 -6.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7740 -3.8570 -5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -3.9510 -1.2530 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 28 1 0 0 0 0 M CHG 1 28 -1 M END