IFLAB-ZINC04070018 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0050 1.4880 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.0010 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -0.5740 -0.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -0.7210 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -2.0980 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -2.5100 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 -1.6020 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -0.0380 0.1410 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -1.8670 0.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7410 -0.8530 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 0.2950 0.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 -1.1360 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1020 -0.0880 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4520 -0.3580 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9030 -1.6660 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0030 -2.7110 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6490 -2.4530 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5780 -4.3480 0.3670 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -3.0180 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -2.8560 0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -3.7170 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -4.7370 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -4.9030 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -4.0530 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 1.8700 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 1.9770 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 1.6910 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 -2.7830 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7520 0.9340 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1590 0.4520 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9610 -1.8720 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9480 -3.2680 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -2.0590 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -3.5920 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -5.4080 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -5.7010 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -4.1860 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 32 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 M END