NCID-ZINC04946097 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 64 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 1.0150 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 3.0270 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 3.4810 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 5.0090 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 6.9100 3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 7.3180 4.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 6.4710 5.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 8.6240 4.9600 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 9.0360 6.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 9.9720 6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 11.0090 6.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 10.5970 5.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 9.6610 4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 12.3150 6.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 12.6430 7.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 13.3680 5.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 15.7540 5.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 17.1250 5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 18.2230 4.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 20.6110 4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1550 19.7610 5.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.3320 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.0740 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.3810 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 3.4080 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 3.4130 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 3.0950 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 3.1000 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 5.3950 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 5.3900 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 7.3050 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 7.3090 3.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5600 9.5610 5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 8.1580 6.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 10.4380 7.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 9.4020 7.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 11.4760 4.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 10.0720 5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 9.1950 3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 10.2320 3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 13.2560 5.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 13.2520 4.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 15.6550 4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 15.6590 5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 17.2210 5.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 17.2250 6.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 18.1270 5.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 18.1230 3.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 20.5940 3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 20.4600 5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 21.5750 5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7290 18.9920 5.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 19.7130 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4370 20.7420 5.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 5.4440 3.5130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 5.0470 3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 14.7010 6.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 14.8060 6.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 19.5390 5.4880 N 0 0 0 0 0 0 0 0 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 1 59 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 60 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 6 60 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 62 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 62 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 64 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 21 64 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 22 64 1 0 0 0 0 60 61 1 0 0 0 0 62 63 1 0 0 0 0 M END