PUBCHEM-ZINC05159569 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.1380 0.5600 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 1.2010 -1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 1.4880 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 2.0800 -2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 2.3610 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 2.0460 -3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 1.4890 -2.6430 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7370 3.0020 -4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 4.7960 -4.6260 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 5.4140 -5.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 6.7920 -4.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 4.4360 -4.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 5.3390 -6.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 2.4080 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4810 3.7310 -1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 1.1940 -0.3260 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1890 -0.5250 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 0.8740 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 0.8660 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 2.2620 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 2.7890 -5.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 2.6000 -5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 5.6120 -6.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 2.3480 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 1.6970 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4050 4.0100 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 1.2820 -2.6810 H 0 0 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 M CHG 1 7 1 M CHG 1 16 -1 M END