PUBCHEM-ZINC06293749 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 30 0 0 1 0 0 0 0 0999 V2000 0.4180 1.5620 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 0.1190 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -0.2400 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -0.7110 -0.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -2.1740 -0.9730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5260 -2.5680 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.5960 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2510 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -2.7340 -3.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -2.4330 -3.8410 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6570 -2.9210 -3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 -2.8140 -5.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 -1.8070 -5.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -2.7930 -0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -1.9430 -1.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 2.2040 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 1.8080 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 1.7450 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -0.3570 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -3.6780 -2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -2.1120 -3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -1.1660 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -2.6870 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -3.8150 -3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -2.2660 -4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -3.9540 -5.6430 O 0 5 0 0 0 0 0 0 0 0 0 0 4.3650 -0.9460 -3.6530 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7430 -0.6890 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -0.3570 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -0.8050 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -4.0360 -0.6770 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 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 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 M CHG 1 26 -1 M CHG 1 27 1 M CHG 1 31 -1 M END