NIH-ZINC04035105 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 74 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.7010 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -2.1450 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -2.3700 -0.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -3.5780 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -4.4790 -0.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 -3.8090 -0.3780 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2580 -3.6310 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4990 -2.8510 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0020 -3.1330 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2270 -4.5950 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 -5.2520 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8970 -6.8820 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3700 -7.1200 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3330 -7.0060 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5050 -7.3030 0.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2460 -7.5940 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9530 -7.4880 -1.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2480 -7.9750 -1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5990 -8.0570 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5300 -8.4130 -2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1270 -8.6890 -3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7850 -8.6070 -4.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8460 -8.2580 -3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0490 -9.0390 -4.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5660 -9.3090 -5.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1380 -6.6190 2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.7130 -2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -0.5000 -2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -0.7340 -3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -1.1800 -4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -1.3920 -4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -1.1550 -3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -0.5230 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -0.0180 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -2.3230 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -2.8280 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -1.6490 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3340 -1.8220 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 -3.0010 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4470 -2.9450 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4650 -2.4820 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2960 -4.8030 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -4.7790 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 -5.4330 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6840 -5.9360 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -7.5150 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -7.1240 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9130 -7.8420 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5750 -8.4770 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4760 -8.8220 -5.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8020 -8.2000 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4020 -9.5760 -6.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8560 -10.1350 -5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0700 -8.4210 -6.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9670 -7.5150 3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0290 -6.1060 2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2770 -5.9560 2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -0.1530 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -0.5700 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -1.3620 -5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -1.7400 -5.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -1.3170 -3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5860 -5.4710 0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 45 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 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 50 1 0 0 0 0 13 51 1 0 0 0 0 13 71 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 14 71 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 15 71 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 63 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 35 2 0 0 0 0 31 32 2 0 0 0 0 31 66 1 0 0 0 0 32 33 1 0 0 0 0 32 67 1 0 0 0 0 33 34 2 0 0 0 0 33 68 1 0 0 0 0 34 35 1 0 0 0 0 34 69 1 0 0 0 0 35 70 1 0 0 0 0 M END