PUBCHEM-ZINC05998487 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -0.8990 0.0100 P 0 0 3 0 0 0 0 0 0 0 0 0 -0.9700 -2.3330 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -0.5600 -1.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -0.8380 -2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -0.3920 -3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 1.4000 -3.5450 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -0.5740 1.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -0.9280 2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -0.0230 3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -0.3860 4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -1.6490 4.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -2.5530 4.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -2.1940 3.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -2.0350 6.1100 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0780 -1.2400 6.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -3.1480 6.5740 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.2980 -2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -1.9090 -2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -0.6840 -4.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 -0.8660 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 0.9640 2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 0.3190 4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -3.5400 4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4150 -2.8980 2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END