PUBCHEM-ZINC05504308 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 0.0660 1.9750 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 0.5330 0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -0.4400 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -1.6230 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -1.3760 -0.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -0.0920 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 0.5760 -2.4900 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0550 1.7870 -2.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -0.0870 -3.5080 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.2480 2.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -1.5300 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -2.0180 3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -3.5120 4.0870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 0.4800 2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 1.0000 4.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 1.9820 4.6160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 2.2430 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 2.5160 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 2.2380 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -2.5950 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -2.2660 2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -1.3960 4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -1.2440 3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -2.2360 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -0.1900 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 1.3200 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 1.6200 4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 0.1580 4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 6 7 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 14 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END