NIH-ZINC04039270 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 2.8300 -0.3730 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -0.9030 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -1.0970 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -1.6010 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -1.7480 -0.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -2.1130 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -1.3230 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -1.3450 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -0.9410 -2.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -1.8920 -3.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -1.9670 -4.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -1.9470 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -0.8020 2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -1.8420 3.7600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9610 -1.1770 4.8510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2330 -0.1490 4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -1.1030 6.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -1.8380 5.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -1.9810 6.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -2.4040 4.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -3.1610 4.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -0.3010 7.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 1.0640 7.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 3.3710 8.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 4.1890 9.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 3.6950 10.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 2.3430 10.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 1.4190 9.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -1.9500 5.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -1.5470 4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 -2.5330 5.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -3.6580 5.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -3.5250 5.8160 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 0.2420 3.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -0.9770 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 0.6590 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -0.3900 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -0.9660 -4.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -2.6010 -4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -2.4190 -5.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -1.2810 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -1.8470 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 -2.9790 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -0.1850 7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -0.8570 8.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 0.9680 7.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.6240 6.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 3.7060 7.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 3.4080 7.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 5.2310 9.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 4.1790 9.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 2.0380 11.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 2.2930 11.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 1.4380 9.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 0.3980 9.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -0.5880 4.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5590 -2.4270 5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -4.5570 6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -2.6580 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.9030 8.3800 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0220 1.8550 8.5910 H 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 34 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 59 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 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 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 60 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 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END