NIH-ZINC04040194 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 -0.2710 1.7720 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 1.1720 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -0.2170 1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -0.3430 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 0.9110 1.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 1.1360 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 1.8500 1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 3.2530 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 4.1230 1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4570 3.4700 1.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 4.8250 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 -1.5290 2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -1.3070 1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -1.9780 3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -3.0440 3.2060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1190 -3.8640 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -3.5450 4.5710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -2.8300 5.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -2.9590 6.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -1.8260 4.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -0.9660 4.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -4.6730 5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -4.2290 5.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -4.8590 7.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -6.0320 8.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2020 -6.9910 7.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 -7.5390 6.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -6.4490 5.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -2.5470 2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -3.1850 1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 -2.7250 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 -1.6410 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -1.0040 3.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -1.4590 3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -1.6560 0.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 2.1450 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 2.6050 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 1.0450 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 4.8800 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4210 5.4850 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 5.1390 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 -1.5620 3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 -1.4950 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -2.4600 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -5.2430 5.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -5.3180 4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -3.8190 5.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -3.4670 6.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -4.1530 8.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 -4.3470 7.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4220 -5.6720 9.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -6.5240 9.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 -8.2770 5.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -8.0680 7.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 -5.9510 5.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -6.8660 5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -4.0320 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 -3.1960 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3360 -1.2410 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -0.9050 4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -1.1680 5.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -5.3780 6.6290 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2310 -5.8130 7.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 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 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 35 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 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 1 0 0 0 0 21 61 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 62 1 0 0 0 0 24 25 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 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 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 62 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 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 34 60 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END