PUBCHEM-ZINC05828229 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.3680 -0.1310 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.0550 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 0.6710 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 1.2560 1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 1.1920 2.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.7390 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -0.0600 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 1.4090 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 2.0840 -3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 3.4620 -3.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 4.1760 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 3.5160 -1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 2.1390 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 5.6550 -2.4950 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1550 6.2400 -3.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 6.2870 -1.5840 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6620 0.8770 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -0.6880 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -0.6360 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 0.8010 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -1.8050 -1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -0.5970 -3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 1.5280 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 3.9840 -4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 4.0800 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 1.6250 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 1.8880 1.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 2.2560 2.3180 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 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 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 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 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END