PUBCHEM-ZINC06293751 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 0.4700 1.5870 -0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 0.1150 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -0.3110 0.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -0.6610 -1.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -2.1280 -1.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4310 -2.5370 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -2.6010 -2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -2.1870 -2.4190 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -2.7410 -4.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 -2.4610 -4.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -2.8890 -5.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0240 -2.6430 -6.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 -1.6890 -6.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -2.7290 -1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -1.9300 -1.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 2.1530 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 1.8350 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 1.8670 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -0.2520 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -3.6880 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -2.1390 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 -3.8130 -4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -2.2070 -4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 -1.3930 -4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -2.9900 -3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 -3.9590 -5.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 -2.3410 -6.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -3.9250 -0.9230 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 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 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 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 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 M CHG 1 28 -1 M END