NIH-ZINC04039825 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 -1.7030 -3.0210 7.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -2.6450 6.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 -3.0010 5.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -2.7150 4.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 -2.2020 5.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -3.1520 3.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1010 -3.0360 2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -3.7570 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -4.1480 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -3.7890 2.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -3.9660 3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -4.8650 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1890 -4.0870 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6750 -4.3730 -0.3130 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.1600 -5.5170 0.6030 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.5230 -5.1080 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2950 -6.1310 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3100 -5.8150 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0610 -6.2080 -2.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2290 -4.8020 -1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9840 -4.3540 -2.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2210 -7.0350 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4960 -7.4100 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8210 -8.3150 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9620 -9.5500 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1460 -6.5800 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6210 -7.1150 2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6710 -8.0820 1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -8.0800 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 -7.1740 -0.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -8.8230 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -4.1640 -1.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 -2.2880 2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -2.7680 8.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -4.0940 7.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -2.5000 6.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -3.1900 7.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 -1.5660 6.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -4.2010 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -5.2110 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 -5.7410 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6530 -7.9390 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5010 -6.5520 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0200 -6.5010 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2730 -8.0290 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6900 -8.8810 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1870 -7.3050 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5050 -8.8260 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0870 -9.4100 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7100 -10.1140 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7450 -10.0560 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 -6.8320 3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -8.6980 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5910 -9.3950 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 -8.1330 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 -9.5220 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2250 -3.4550 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6430 -1.8420 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2010 -2.9490 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 -1.4570 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4790 -8.1960 0.6770 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.6390 -7.6540 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 32 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 61 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 61 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 61 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END