NIH-ZINC04937975 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 -0.1020 1.6160 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 0.1870 0.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.4400 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -1.8280 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -2.4680 2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -1.7200 3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.3250 3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 0.3080 2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -2.4020 4.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -1.8120 5.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -2.9000 6.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -3.9810 5.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -3.7290 4.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 -2.8290 7.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -3.6510 8.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 -3.5780 9.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -4.3870 10.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 -4.9660 10.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 -4.4690 12.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -5.2550 13.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 -6.2780 13.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8120 -5.5830 14.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4920 -4.7970 13.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -3.7780 12.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3240 -5.6640 15.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4080 -5.1690 15.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5740 -6.3490 16.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 -6.4060 17.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -7.1580 18.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -7.5220 17.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -7.0280 16.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 1.9910 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 1.9880 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 1.9580 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -2.4060 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -3.5470 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 0.2570 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 1.3860 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -0.7580 5.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 -3.2290 7.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -1.7900 7.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -3.2500 8.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -4.6890 8.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 -3.9780 9.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -2.5390 10.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 -4.5920 13.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -5.7740 12.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -6.7360 14.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7650 -7.0460 13.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3460 -4.2770 13.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8310 -5.4590 12.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -3.3230 11.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 -3.0080 13.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7900 -5.9600 18.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -7.4000 19.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 -8.1110 17.5950 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 M END