NIH-ZINC04014511 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 65 0 0 1 0 0 0 0 0999 V2000 1.1220 -1.0390 5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -1.9820 3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -2.5080 4.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -3.3690 3.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -3.7000 2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -4.5720 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -5.1270 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -4.7910 2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -3.9220 3.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 -3.5100 4.3370 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -6.0580 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -6.6530 -0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3510 -8.0680 0.5980 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0180 -8.1210 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -8.9800 -0.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 -8.3210 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -8.8460 -2.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -6.8570 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -6.0030 -2.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -10.4300 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 -10.7700 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -12.7100 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8540 -12.6090 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -8.4250 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -9.1380 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -9.4670 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -9.0860 1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -8.3710 2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -8.0340 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -7.3280 3.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -8.0790 4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -7.9950 3.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -8.3700 4.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -6.3470 -0.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -0.6380 5.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -0.2200 5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -1.5870 6.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -1.4350 3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -2.8020 3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -3.2710 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -4.8280 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 -5.2160 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -10.9200 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -10.7790 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5010 -10.2800 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 -10.4210 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8350 -12.2290 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 -12.4730 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -13.7900 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4790 -12.2980 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2000 -12.1230 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9160 -13.6900 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -9.4390 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -10.0240 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -9.3450 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -8.6850 4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -7.3970 4.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -8.7300 3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -7.9320 3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -8.0090 5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -9.4560 4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -6.0160 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4600 -12.2240 0.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 34 2 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 62 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 63 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 63 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 63 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 M END