PUBCHEM-ZINC05159829 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 -1.2680 1.5320 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 0.0270 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -0.5370 2.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -0.0180 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -2.0840 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -2.6620 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -4.0420 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -4.7970 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 -4.1550 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -2.8380 -0.0320 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.3830 -2.2160 -0.2080 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3580 1.9370 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 1.8820 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 1.8670 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 0.1600 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -0.6460 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 0.9330 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 -2.0450 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -4.5190 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -5.8750 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 -4.7380 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 M CHG 1 11 1 M CHG 1 12 -1 M END