PUBCHEM-ZINC06218755 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.6210 1.9910 0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 0.5350 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -0.3430 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -1.7210 1.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.1650 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -3.3400 -0.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -1.2180 -1.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -1.5420 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 0.1140 -0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 0.9030 -1.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -2.7380 2.5230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -4.0410 2.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -1.9400 3.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -2.9550 3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -3.0620 2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8090 -3.1010 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1450 -3.0350 3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -2.9650 4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -2.9440 4.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -2.9960 5.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -3.9470 5.4910 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1770 2.5980 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 2.2960 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 2.2250 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -0.0400 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -3.1210 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -3.1780 1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -3.0580 4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -2.9440 5.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -2.1290 6.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 18 2 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 30 2 0 0 0 0 M CHG 1 21 -1 M END