PUBCHEM-ZINC02931555 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.2970 1.5780 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 0.2250 1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -0.6070 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -0.0800 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 1.2700 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.1140 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 3.5550 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 4.2230 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 3.6640 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 2.4680 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 4.5570 -0.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 5.8570 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 7.1580 -0.3920 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 5.9750 -0.2030 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 4.1250 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 4.5760 -1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8480 4.1250 -1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5900 4.7490 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 4.2990 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 4.7490 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -0.9720 -0.8290 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7890 -0.5120 -1.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -2.1670 -0.5930 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3960 2.2230 1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -0.1890 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 1.6790 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 4.0830 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 3.0390 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3400 5.6620 -1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 4.1310 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 4.4460 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 3.0390 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5440 5.8360 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6320 4.4280 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 4.7430 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 3.2120 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 4.4280 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4270 5.8360 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -1.9390 1.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -2.4520 0.5220 H 0 0 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 14 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 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END