PUBCHEM-ZINC05134238 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.0500 1.5440 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 0.0320 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -0.1430 -1.1350 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7940 -0.6470 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 1.3830 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 1.9780 0.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5570 3.0720 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 1.6080 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 1.3580 1.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -0.5520 -2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 -0.8520 -3.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 1.9090 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.9950 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.3860 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -0.2860 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 1.6860 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 1.8230 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -0.5880 -1.0690 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8130 -1.6100 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -0.4660 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 1.5750 2.3810 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0870 -0.5600 -2.6710 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 3 18 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 21 -1 M CHG 1 22 -1 M END