PUBCHEM-ZINC02047678 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 37 0 0 0 0 0 0 0 0999 V2000 -0.0060 1.8830 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 0.4370 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -0.2660 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 0.2470 2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -0.1250 3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -0.0800 5.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.1930 6.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 0.9770 7.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 2.3730 7.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 3.2170 6.5270 P 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 2.6730 5.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 4.6780 6.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 6.1640 6.2370 P 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 6.4380 7.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.2040 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 2.4930 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 1.9970 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 2.2940 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -1.3140 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -0.2090 2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 1.3280 2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 0.3060 3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -1.2130 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 0.2780 4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -1.1720 5.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 0.3390 6.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.8830 6.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 0.5160 5.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 0.6520 8.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 0.7720 7.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 0.3290 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -1.2520 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -0.1760 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 0.3930 5.0330 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2180 1.4930 4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 2.9740 7.4000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4140 6.0850 4.7350 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0030 7.0550 6.6240 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 15 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 5 34 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 34 1 M CHG 1 36 -1 M CHG 1 37 -1 M CHG 1 38 -1 M END