CHEMDIV-ZINC04790861 MOE2007 3D CORINA 3.40 0006 02.08.2006 74 78 0 0 0 0 0 0 0 0999 V2000 0.5250 0.7320 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -0.6260 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -1.0750 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 -0.1550 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 1.2280 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 1.6560 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 2.1690 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 1.6980 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 0.3640 0.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 -0.5740 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 -1.7550 0.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9150 -0.0630 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3490 -0.1380 1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 0.1380 2.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6070 -0.5120 2.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0290 -0.5860 3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4900 -1.0320 3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9310 -1.1080 4.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7240 -1.8500 6.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1720 -2.3480 6.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0180 -1.3570 5.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6670 -1.0280 4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2250 -0.5170 4.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 3.9030 -0.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 4.5150 -0.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 4.0740 -0.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 4.3970 1.4820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 4.7000 2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 3.9260 3.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 4.2270 4.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 3.7750 3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 4.5490 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 3.6700 5.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 2.2970 5.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 1.7500 6.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 2.5670 7.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.9350 7.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 4.4910 6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 5.8280 6.2180 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 1.0620 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -1.3380 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -2.1330 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 2.7100 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0560 2.4020 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 -1.0450 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5400 0.6550 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2330 -0.7330 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9260 0.3960 3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 -1.3040 3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5930 -2.0140 3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1150 -0.3130 2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8280 -0.1260 5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3060 -1.8270 5.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0680 -2.6250 6.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6400 -0.9540 7.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4830 -2.5270 7.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2440 -3.2740 5.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3370 -0.2530 4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7540 -1.9160 3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1490 0.4010 5.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9340 -0.3180 3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1300 4.3940 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 5.7700 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 2.8570 3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 4.2240 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 2.7080 2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 3.9630 3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 5.6050 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 4.1430 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 1.6580 4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 0.6820 6.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 2.1350 8.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 4.5700 8.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3340 -1.5370 5.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 40 1 0 0 0 0 2 3 2 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 18 74 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 19 74 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 23 74 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 70 1 0 0 0 0 35 36 1 0 0 0 0 35 71 1 0 0 0 0 36 37 2 0 0 0 0 36 72 1 0 0 0 0 37 38 1 0 0 0 0 37 73 1 0 0 0 0 38 39 1 0 0 0 0 M END