NIH-ZINC06577381 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 1.0380 -0.5820 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0070 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6400 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -0.1360 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -0.7780 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9290 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -2.4330 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -1.7870 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -2.5810 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0270 -1.8670 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 -0.6550 0.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -2.5750 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4740 -1.5400 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8220 -2.2620 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7700 -3.2260 1.5890 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6780 -4.2080 1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -3.4640 1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9200 -3.2050 2.7800 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.3300 -3.8140 3.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4600 -1.8900 2.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2240 -4.2720 2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4950 -5.4070 2.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5210 -6.2660 2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2820 -5.9920 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0320 -4.8300 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9920 -3.9520 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7530 -2.8420 0.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.4670 -2.5380 -0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5070 -3.3540 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7960 -4.5100 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 0.0200 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.5960 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.6070 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 0.7600 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -0.3850 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -3.3280 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -2.1770 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -3.5470 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 -3.1900 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3220 -0.9410 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4650 -0.8920 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6140 -1.5360 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0160 -2.7900 -0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7150 -4.7660 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7790 -4.8940 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5290 -4.1860 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2020 -2.8460 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9040 -5.6460 3.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7140 -7.1600 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0740 -6.6660 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2430 -1.6320 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0770 -3.0770 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5980 -5.1550 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 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 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 18 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 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 M END