NIH-ZINC06498806 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 71 0 0 1 0 0 0 0 0999 V2000 -1.5340 -0.3750 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -1.7630 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -3.1060 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -3.6140 2.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -4.0980 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -3.9620 -1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -5.1190 -2.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -5.1470 -3.7610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5300 -4.3640 -4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -6.4860 -4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -7.1660 -3.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -6.3010 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -6.6250 -1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -8.4170 -3.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -6.8780 -5.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -6.4200 -6.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -7.8000 -6.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -8.9600 -7.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -9.5080 -7.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -8.7190 -7.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -8.9000 -7.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -7.6690 -6.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -6.6430 -6.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -10.6620 -8.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -11.3850 -8.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -10.8260 -9.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -11.9350 -10.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -9.4790 -7.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -4.9630 -3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 -5.9870 -2.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -5.8110 -2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 -4.6090 -2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -3.5790 -3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -3.7480 -3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 -2.7720 -4.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -1.7290 -5.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -0.2150 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -0.2030 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 0.3820 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -1.9660 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -1.8640 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -3.8260 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -2.1720 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -4.5600 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -2.8850 2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -3.7790 3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -4.2980 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -4.9220 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -3.0670 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -3.8770 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -8.5670 -2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -6.9350 -5.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -6.5210 -7.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -5.6670 -6.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -12.8720 -9.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -11.8060 -10.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 -11.9700 -10.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -9.2640 -8.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -10.5610 -7.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -9.0280 -6.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -6.9380 -2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1360 -6.6140 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2350 -4.4730 -2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9510 -2.6530 -3.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -1.1570 -5.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -2.1290 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -1.0460 -4.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -2.8210 0.4110 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1400 -2.4450 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 2 68 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 3 68 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 5 48 1 0 0 0 0 5 68 1 0 0 0 0 6 7 1 0 0 0 0 6 49 1 0 0 0 0 6 50 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 51 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 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 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 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 32 33 2 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 33 64 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 65 1 0 0 0 0 36 66 1 0 0 0 0 36 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END