NIH-ZINC04092935 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 0.0620 -2.2760 2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -2.9660 1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -3.1750 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -2.6950 1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -2.0050 2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -1.7960 3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 -2.9250 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -1.7640 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 -2.0090 -0.5220 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 -3.0130 -1.5840 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9620 -2.5370 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5990 -4.0780 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4490 -4.6580 -2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3380 -5.6310 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3820 -6.0080 -0.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5890 -5.4780 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 -4.4960 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -3.6410 -1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 -2.9390 -2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -4.9820 -1.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -5.5920 -2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 -6.9720 -1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -7.6090 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -7.7550 -3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -6.3750 -3.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -5.7380 -3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5960 -1.3120 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6650 -1.5150 -0.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4850 -0.2790 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7950 0.3350 1.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9380 1.2930 2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9770 1.6480 2.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2500 1.9080 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5310 2.8830 3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9000 3.1700 3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3870 2.3670 2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3910 1.6040 1.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -2.1080 3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -3.3410 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -3.7150 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -1.6300 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -1.2570 4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -2.9860 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -3.8570 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 -1.6810 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 -0.8370 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4180 -4.3540 -3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0040 -6.0880 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6540 -5.8130 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 -4.0620 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 -5.5430 -1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -4.9580 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 -7.6050 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -6.8680 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -8.5920 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -6.9750 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -8.3880 -3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -8.2080 -3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -6.4790 -4.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -5.7420 -3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -4.7550 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 -6.3710 -3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 0.4890 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1430 -0.7560 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5610 0.0520 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8360 3.3450 3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 3.8960 3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4120 2.3410 1.8180 H 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 38 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 30 65 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 2 0 0 0 0 33 37 1 0 0 0 0 34 35 1 0 0 0 0 34 66 1 0 0 0 0 35 36 2 0 0 0 0 35 67 1 0 0 0 0 36 37 1 0 0 0 0 36 68 1 0 0 0 0 M END