PUBCHEM-ZINC00194782 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 0.1770 0.5290 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.0420 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -0.4040 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -0.1980 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 0.3780 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 0.7400 2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -0.6160 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1810 -0.1030 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 -1.6410 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 -2.1870 1.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 -1.9930 -0.5060 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8490 -1.4610 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 -0.5410 -2.1330 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9270 -0.1050 -1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 0.7540 -2.2050 O 0 5 0 0 0 0 0 0 0 0 0 0 7.2010 -1.8960 -2.6730 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2100 -3.7110 -2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8170 -4.0500 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1430 -3.6140 -0.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 0.8110 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -0.2060 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -0.8450 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 0.5470 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 1.1870 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 -2.7370 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 -4.1120 -2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8190 -4.1190 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8810 -4.7220 -1.2100 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 14 2 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 28 -1 M END