IFLAB-ZINC04304869 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 2.1240 -2.0340 3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -1.2170 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 -2.0410 1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.7930 1.5490 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 0.2110 0.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -1.9680 1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.0120 2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -0.5660 3.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 0.3410 4.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 0.2660 5.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 1.3830 5.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 2.5970 5.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 2.6950 4.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 1.5700 3.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 1.3280 3.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 2.3080 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 2.9970 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 2.7660 0.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 3.8690 0.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 4.0940 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 5.6070 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 6.1200 -0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 5.6630 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 4.5720 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 4.1680 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 4.8500 -2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 5.9360 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 6.3460 -2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -2.9020 3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 -2.3670 4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -1.4160 4.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -0.3030 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 -2.9550 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 -1.4590 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -2.2960 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 -0.6740 5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 1.3210 6.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 3.4710 6.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 3.6420 4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 3.0480 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 1.8000 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 3.7020 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 3.5990 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 6.1040 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 5.8110 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 7.2100 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 5.7400 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 3.3210 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 4.5360 -2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 6.4700 -3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 7.1940 -2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 M END