PUBCHEM-ZINC05113887 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 0.7740 0.6080 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -0.7800 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -1.6810 2.1440 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4890 -1.7110 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -3.1090 2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -3.3670 3.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 1.5400 0.2900 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6330 1.6720 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 2.9120 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 0.9090 -0.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 1.0230 -1.2730 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0290 0.6070 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 0.2830 -2.5650 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1690 0.6220 -3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 0.5230 -2.8920 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9170 -0.0360 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 2.0120 -2.8540 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7500 2.1370 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 2.6670 -1.5700 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6390 2.2430 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 2.4060 -1.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 4.1910 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 4.6860 -0.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 5.5670 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 2.6420 -3.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 2.0160 -4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 0.0160 -4.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2110 -0.8990 -4.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -1.1260 -2.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -1.2540 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 0.4940 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 1.0570 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -1.2580 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -0.6800 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 2.8260 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 3.3790 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 4.4820 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 4.6720 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -3.7550 1.0850 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6590 -1.1860 3.5750 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2430 -1.0420 4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -0.4330 3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -2.0700 4.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 3.8490 -0.5740 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6120 4.6660 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 3.3320 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 4.1700 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 40 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 M CHG 1 39 -1 M CHG 1 40 1 M CHG 1 44 1 M END