IFLAB-ZINC04164324 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 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 0.5980 -0.6000 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 0.0700 -1.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.1040 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -2.5980 -2.6370 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -4.3580 -2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -5.1130 -3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -6.4720 -3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -7.1070 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -8.3760 -2.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -8.4400 -0.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -7.2230 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -6.3430 -1.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -4.9500 -1.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -6.8790 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -7.8480 1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -7.5200 2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -6.2350 3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -5.2700 2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -5.5840 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -5.8310 4.5270 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -2.4910 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -2.5070 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -4.6120 -4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -7.0560 -4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -8.8510 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -8.2690 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 -4.2690 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -4.8290 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 M END