ANALYTICONDISCOVERY-ZINC04260908 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 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 0.6520 -0.5700 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -2.0740 -1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.8080 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -4.1040 -0.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -4.1400 -1.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -2.9450 -1.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -5.2680 0.3980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4720 -6.1250 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -4.9420 1.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -5.6390 2.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -5.4630 1.4830 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8660 -4.5130 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -5.6060 0.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0750 -4.9590 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -7.0080 -0.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -7.4100 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 -6.6770 1.5610 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0220 -7.3220 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 -6.2330 1.6880 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 -7.1060 2.6040 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 -6.4070 2.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6100 -8.4620 2.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1990 -7.0200 4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -5.9890 5.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 -5.8930 6.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3520 -6.8460 6.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -6.7810 8.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -7.7220 8.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 -8.7530 7.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 -8.8480 6.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -7.8950 6.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3390 -7.9640 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -0.2510 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -0.2340 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -2.4360 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -5.3100 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -3.8690 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 -7.0900 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 -8.4910 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 -5.4280 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3380 -5.2550 4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6030 -5.0880 7.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -5.9870 8.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -7.6690 9.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -9.4880 8.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -9.6520 5.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -8.7600 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 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 40 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 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 34 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 33 1 0 0 0 0 32 51 1 0 0 0 0 33 34 1 0 0 0 0 34 52 1 0 0 0 0 M END