IFLAB-ZINC04248859 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0480 1.5020 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -0.7040 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -2.0850 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -2.7720 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -2.0670 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.6850 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 0.1980 2.0940 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1710 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -4.8400 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -4.2320 -2.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -6.3450 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -6.9430 -2.8870 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -8.6780 -2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -9.2620 -1.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -10.5930 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -10.8530 -2.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -9.6410 -3.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -9.4280 -4.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -9.3200 -5.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -10.3430 -6.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -9.7940 -6.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -8.4680 -6.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -8.1860 -5.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 1.8470 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 1.8820 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 1.8680 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -0.1700 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -2.6300 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -2.5980 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -4.6580 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -6.7630 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -6.6540 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -11.3280 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -11.8270 -3.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -10.2670 -5.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -8.5070 -5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -11.3850 -6.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -10.3350 -6.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -7.7510 -6.4480 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 31 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 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 M END