NIH-ZINC04118980 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 69 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -0.7010 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -1.1460 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -1.3840 -3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -1.1690 -3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.7290 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -1.8600 -4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 -2.1170 -5.8870 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -2.5260 -6.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -2.5180 -6.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -2.0970 -4.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 -2.9040 -6.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -2.9230 -8.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 -2.1220 -10.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -0.8880 -11.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 0.1620 -11.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 0.5070 -9.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -0.7680 -8.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 1.4040 -11.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 1.4460 -12.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 2.4670 -11.8110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 3.6740 -12.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 4.7060 -12.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 4.8840 -13.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 5.8310 -13.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 6.6030 -11.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 6.4290 -10.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 5.4760 -11.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 5.2990 -10.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 6.1260 -9.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -0.5170 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 -1.3100 -2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -1.3500 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -0.5660 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -2.0240 -7.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2210 -3.3090 -5.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4460 -3.6570 -7.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 -3.6700 -8.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -3.3400 -8.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -2.5420 -10.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -2.8660 -10.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 -0.4750 -11.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 -1.1690 -12.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -0.2360 -11.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 0.9420 -9.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 1.2220 -9.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -0.5280 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -1.1950 -9.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 2.4330 -11.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 4.0730 -12.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 3.4270 -13.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 4.2820 -14.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 5.9680 -13.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 7.3420 -11.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 7.0320 -10.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 5.8840 -8.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 7.1740 -9.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 5.9520 -8.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 -1.7400 -9.0460 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 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 66 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 66 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 20 66 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 28 29 2 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 62 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 M END