NIH-ZINC04040190 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 -0.6060 1.7280 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 1.2630 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -0.0890 1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -0.0690 2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 1.2270 1.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 1.5490 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 2.0540 1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 3.4680 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 4.2420 0.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 3.8190 1.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 5.1960 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -1.1410 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -1.2600 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -2.2660 2.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -3.7330 2.3940 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2450 -3.9610 1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -4.2920 3.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -3.3320 4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -3.4690 5.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -2.0300 4.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -0.8460 4.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -5.6920 3.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -5.8960 3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -7.3180 4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -8.7000 5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -9.7210 4.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -9.7360 4.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -8.4070 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -4.2870 1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -4.4860 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -4.9700 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -5.2520 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -5.0820 2.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -4.5940 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -1.4370 0.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 1.0180 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 2.6840 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 1.8560 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 5.3620 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 5.4410 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 5.8390 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 -2.0740 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -0.8620 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 -1.3280 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -5.9800 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -6.3030 3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 -5.7790 2.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -5.1650 4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 -6.5380 5.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 -7.1100 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 -8.7590 5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -8.8960 6.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -10.5500 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -9.9600 5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -8.2070 2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -8.4000 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -4.2360 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -5.1100 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 -5.6280 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -4.4580 3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -1.0570 5.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 -7.2650 4.4870 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5020 -7.4100 5.3740 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