PUBCHEM-ZINC05420661 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 2.2510 1.4120 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 0.0310 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.6800 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 0.0000 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 1.3810 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 2.1070 -1.1230 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9760 1.4860 -1.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 3.3250 -1.1180 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2380 -2.0770 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.7960 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -4.0870 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -4.7940 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -4.2190 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 -2.9340 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -2.2240 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -4.9800 0.4360 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6560 -6.1110 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 -4.4750 0.9800 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0740 1.9660 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -0.4950 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -0.5500 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1660 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -2.5480 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -4.5360 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -5.7980 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -2.4880 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -1.2220 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 17 1 M CHG 1 19 -1 M END