IFLAB-ZINC04569188 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.2100 -0.3180 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -1.7840 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -2.6330 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -3.9780 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -4.4740 -1.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -3.6260 -3.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -2.2810 -2.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -1.3570 -4.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -0.6290 -4.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 0.2600 -5.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 0.4580 -5.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 1.0020 -5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 0.8780 -4.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 1.8100 -6.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 2.4630 -6.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 3.4000 -7.5250 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9540 4.1200 -7.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 2.5810 -8.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 3.3120 -9.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7240 3.7410 -8.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 4.1060 -7.5940 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 5.1370 -6.4440 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 6.0660 -7.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 5.5270 -5.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7170 4.1950 -5.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0320 3.9800 -5.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8670 3.2410 -4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3870 2.7180 -3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0720 2.9330 -3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 3.6760 -4.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 0.2180 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 0.0750 -2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -0.1880 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -2.2460 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -4.6410 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -5.5250 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -4.0130 -4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -1.9400 -5.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -0.6470 -4.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -0.7880 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 1.9580 -6.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 3.0380 -5.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 1.7070 -6.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 1.5510 -8.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 2.6160 -9.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9380 2.6320 -10.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 4.1800 -10.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4140 2.9130 -8.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 4.6020 -9.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4070 4.3900 -6.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8940 3.0730 -5.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0390 2.1400 -3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6970 2.5240 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 3.8470 -3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 M END