PUBCHEM-ZINC02033573 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 -0.2110 0.8670 -1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.6210 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -1.2660 -1.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -1.1360 -0.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -2.5580 0.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1610 -3.0420 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -3.2870 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -3.5570 -2.4790 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -3.7770 -3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -5.3500 -3.5310 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -2.6030 -3.5630 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3250 -2.6150 -3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -1.2680 -3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -2.6990 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -1.6800 1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 1.1570 -2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 1.1710 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 1.3760 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -0.5360 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -4.2750 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -2.7120 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 -1.8110 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 -2.4370 -5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8230 -3.5540 -3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -1.2960 -3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 -0.6550 -4.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -0.8090 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -3.7920 2.1090 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 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 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