PUBCHEM-ZINC05688462 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.1100 -2.1150 1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.1910 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -0.5320 -0.0610 P 0 0 3 0 0 0 0 0 0 0 0 0 -2.7160 -0.6050 -1.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 0.4760 -0.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 1.8340 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 0.0050 1.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 -0.5710 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 -1.7200 2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0920 -2.3040 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2240 -1.7430 1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1230 -0.5960 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -0.0060 0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5470 -2.3700 2.0820 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.6370 -3.3800 2.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5450 -1.8760 1.5880 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2960 -3.1060 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -1.4320 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -1.7510 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -2.5540 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -2.8730 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 2.3850 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 2.2880 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 1.8640 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -2.1600 2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 -3.1990 3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0090 -0.1600 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 0.8910 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END