NIH-ZINC06498986 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 1.1600 0.3530 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 0.4270 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 1.8620 -1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 2.4850 -2.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 1.1200 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 2.3660 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 1.9900 2.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 1.9440 3.8560 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8540 2.9320 4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 1.5020 4.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 1.3210 4.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 1.6310 2.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 1.5680 1.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6160 0.9240 4.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 1.3080 6.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 1.0120 6.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 1.4700 6.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 2.6850 7.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 2.3780 7.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 1.0140 7.7530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 0.5300 8.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 0.4610 7.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -1.0080 6.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 3.3360 8.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 4.5220 8.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 2.9020 8.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 3.9060 9.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 4.0590 7.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 0.9520 3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 1.1690 4.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -0.0200 4.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -0.8930 3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -0.3000 3.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -0.4540 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 1.2980 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 0.1620 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 0.6350 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -0.5240 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 2.5800 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 0.9680 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.7660 -3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 2.7530 -3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 3.3790 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 0.6620 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 0.4090 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 3.0820 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 2.8190 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 0.8470 3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -1.2690 5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -1.5900 7.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -1.2260 6.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 4.6230 8.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 4.4240 10.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 3.4230 9.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 4.2750 8.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 4.8000 7.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 4.0970 6.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 2.0780 4.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -0.1940 4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -1.9000 3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.5000 -0.6410 N 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 37 1 0 0 0 0 2 38 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 61 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 48 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 M END