NIH-ZINC04039873 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 65 0 0 1 0 0 0 0 0999 V2000 -0.5280 2.0210 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 1.3350 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 0.0170 2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -0.2320 2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 0.8920 2.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 1.0130 2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 1.8540 1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 3.1310 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 4.0130 0.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 3.2070 1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 4.4260 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -1.4310 3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -0.9200 2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -1.5040 3.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -2.7430 3.4390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0900 -3.5590 2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -3.0590 4.8610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -2.0870 5.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -2.0080 6.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -1.0960 4.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 0.0010 5.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -4.2600 5.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 -4.0000 6.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 -6.4050 5.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -4.7950 7.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -2.5690 2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -3.5390 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 -3.4200 1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -2.3320 1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -1.3630 2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -1.4820 3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 -2.3380 1.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 -1.1760 1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -1.2350 1.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 2.0930 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 3.0310 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 1.4860 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 5.2790 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 4.5430 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 4.3770 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -1.3460 4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7150 -1.5440 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -2.3450 2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -4.6070 6.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -5.0320 4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -3.8010 5.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -3.1410 6.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -6.1480 5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -6.7370 5.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -7.1880 6.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -3.9600 8.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 -4.5110 6.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -5.6550 8.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -4.3970 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -4.1770 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 -0.5030 3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -0.7080 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2550 -0.2810 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9660 -1.0590 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6890 -1.3070 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -0.0440 6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -5.1820 6.8280 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3740 -5.4290 7.5020 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 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 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 1 0 0 0 0 21 61 1 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 62 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 62 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END