PUBCHEM-ZINC04530734 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 1 0 0 0 0 0999 V2000 0.4350 2.0450 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 0.5290 0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 0.0200 1.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -0.9530 2.6510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7990 -0.5840 3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -2.2560 2.6020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7170 -2.7880 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -3.0820 1.4720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7220 -4.0000 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -2.2800 0.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -1.3340 1.9040 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1280 -1.7360 2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -0.0870 1.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -3.4230 0.4150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9610 -4.0670 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -4.1480 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -4.5690 -1.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -2.2180 -0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -1.9610 2.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -2.7860 2.2960 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7160 -3.6110 2.3020 N 0 5 0 0 0 0 0 0 0 0 0 0 0.8900 0.1980 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 2.5090 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 2.4290 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 2.2780 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -5.0190 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -3.4730 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -5.0370 -2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -1.6550 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 0.5080 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -0.8760 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 0.7260 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 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 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 20 21 2 0 0 0 0 22 30 1 0 0 0 0 22 31 1 0 0 0 0 22 32 1 0 0 0 0 M CHG 1 20 1 M CHG 1 21 -1 M END