NIH-ZINC04166553 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 2.8260 -9.4700 -2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -8.2760 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -7.2940 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -6.1670 -1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -6.0270 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -6.9740 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -8.0980 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.5680 0.2320 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -4.3180 1.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -3.5390 -0.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -4.9660 0.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -5.0270 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -6.4630 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 -7.3610 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 -7.2600 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -5.8010 1.5560 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1350 -5.4480 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -5.6910 2.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -6.6400 3.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -4.4940 3.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -4.3450 4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -3.1770 4.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -2.0790 3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -3.2970 3.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.7380 4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 0.5930 3.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 1.2280 4.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 2.4420 4.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 3.0350 3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 2.4210 2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 1.2040 2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 -9.2500 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -10.3380 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -9.7480 -3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 -7.4010 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -5.4130 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -6.8530 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -8.8370 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -4.5630 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -4.4310 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -6.4740 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -6.8760 -1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -7.0720 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -8.4000 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -7.8650 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -7.7010 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -4.1650 5.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -5.2590 5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -2.9910 5.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -3.3580 4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -2.1830 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -1.1760 2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 -3.4320 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 -3.1180 3.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -0.9970 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -0.6920 5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 0.7920 5.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 2.9320 5.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 3.9810 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 2.8930 1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 0.7390 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -1.8930 4.3620 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1380 -1.6610 5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 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 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 62 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 62 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 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 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END