PUBCHEM-ZINC05531977 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 22 0 0 1 0 0 0 0 0999 V2000 -0.3570 1.4250 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -0.0670 -0.1570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5640 -0.3790 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -0.9350 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -2.0180 0.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 0.0640 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -0.5810 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -1.7400 -0.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.1200 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -0.5590 3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -1.6610 3.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 2.0300 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 1.6450 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 1.7690 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -0.2100 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 1.1550 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -0.0780 2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 1.2020 2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -0.4690 -1.0040 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7660 -0.3330 1.1170 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7700 -1.3750 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 0.1370 -0.5110 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3100 0.0820 4.7870 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 9 20 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 19 -1 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 23 -1 M END