IFLAB-ZINC04134578 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5660 0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0870 4.1600 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 4.1890 0.0030 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9360 -0.8290 -0.0400 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 -1.8080 -1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 0.1650 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 -1.6590 1.3890 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -2.3870 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 -3.1270 2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 -3.8760 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3790 -3.9590 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3620 -4.6390 2.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2780 -3.2240 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1920 -2.4770 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -2.4150 -0.0220 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9650 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 -3.0660 3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 -4.4180 4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0770 -3.2870 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -1.9400 -0.2900 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 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 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 28 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END