NIH-ZINC04003631 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 0.1520 1.3440 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.1680 -0.1610 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3420 -0.6760 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -0.6030 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.2240 1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -0.8240 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -0.7580 2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 -1.5160 4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -2.3170 4.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -2.4020 3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -1.6430 2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -1.4810 1.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -2.0950 1.9900 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2110 -2.0540 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -1.3580 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -1.5500 1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 0.1340 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -0.6460 -1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 -1.6740 -2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 -2.3900 -3.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -2.0770 -4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -1.0490 -4.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -0.3300 -3.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -3.5540 1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -4.2220 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 -3.5930 2.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -5.5190 1.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -6.1680 1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -7.6060 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -8.5930 2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -9.9130 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -10.1910 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 -9.1510 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 -7.9080 -0.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 1.6120 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 1.6430 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 1.8560 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 -0.1380 2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 -1.4880 4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -2.8920 5.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -3.0290 4.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 0.1560 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 1.1520 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0990 -1.9180 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -3.1930 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 -2.6360 -5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -0.8050 -5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 0.4760 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -3.5930 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -4.0720 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -6.0220 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8240 -6.1290 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 -5.6510 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -8.3400 3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -10.7050 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 -11.2070 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -9.3590 -1.6880 H 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 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 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 25 1 0 0 0 0 15 16 2 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 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 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 55 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 34 2 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 M END