NIH-ZINC06578074 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 2.8170 0.8680 2.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -0.5890 2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -1.1470 2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -2.5020 2.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -3.5310 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -4.7920 1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -5.0490 1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 -4.0220 1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -2.7200 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -1.5550 2.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.4650 2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -1.0780 2.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.9800 2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 1.5890 4.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 3.0500 3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 3.8710 4.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 3.3400 2.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 2.0740 1.9220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4480 2.0430 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 1.9190 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 1.4500 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 1.3060 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 1.6320 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 2.1020 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 2.2400 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4680 1.4930 -0.1970 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 4.6800 2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 5.2140 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 6.6140 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 6.3360 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 8.5500 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 0.9580 5.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 1.0800 3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 1.0960 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 1.4820 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -3.3400 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -5.6010 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -6.0550 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -4.2080 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 1.1950 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 0.9400 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 2.3570 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 2.6020 3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 4.6330 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 5.3460 2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 5.2620 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 4.5490 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 6.5660 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 7.2790 1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 6.3880 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 5.2990 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 6.7370 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 9.1210 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 8.6810 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 8.9040 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 1.5550 6.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 7.1270 0.5040 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 32 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 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 57 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 57 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 57 1 0 0 0 0 32 56 1 0 0 0 0 M END