NIH-ZINC04040062 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 68 0 0 1 0 0 0 0 0999 V2000 0.0380 2.8440 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 1.4590 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 0.3290 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -0.7270 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -0.2800 -0.6290 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -0.8160 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 1.0570 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 1.9040 -1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 3.0770 -1.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 1.3820 -3.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 2.2790 -4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -2.1350 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 0.2820 2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -0.4050 3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.6840 4.8530 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1340 0.2540 5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -1.4390 4.8860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -1.6140 3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -2.2030 3.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -0.9770 2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -0.9580 1.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -1.9240 6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -0.8580 6.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3550 -0.2690 8.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -2.4930 7.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -1.5010 5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -2.8450 5.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -3.5970 5.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -3.0090 6.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -1.6630 6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -0.9040 6.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 0.4190 6.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 0.7670 7.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -1.0830 7.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 -1.9220 8.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 0.9100 3.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 3.4230 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 3.3360 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 2.7760 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 1.7330 -5.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 2.6740 -4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 3.1010 -4.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -2.7190 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -2.5880 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -2.1170 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -2.8380 5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -2.1320 6.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 0.0550 6.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 -0.6510 5.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1090 0.1090 7.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6780 0.5400 8.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -0.6560 9.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8560 -3.3020 7.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2160 -2.1960 6.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 -2.8340 8.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -3.3080 4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -4.6460 5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -3.5990 7.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 0.4160 7.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 0.3000 8.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 1.8500 7.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -1.3360 8.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 -2.7360 8.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -2.3330 7.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 0.8660 4.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 -1.3450 7.8120 N 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 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 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 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 2 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 66 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 66 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 66 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 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 36 65 1 0 0 0 0 M END