NIH-ZINC04039073 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 -2.8610 0.2960 4.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -0.7230 3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -1.0630 2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -2.1470 2.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -2.9220 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -3.9210 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -4.1710 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -3.4270 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -2.3630 1.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -1.5020 2.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -0.4780 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 0.9870 3.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 1.8390 2.2380 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2290 1.7860 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 3.1650 2.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 3.1180 4.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 4.0390 4.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 1.6910 4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 1.2540 5.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 4.4000 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 4.8110 2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 6.6950 2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 8.0990 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 8.1070 0.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 7.7190 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 6.2940 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 1.5340 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 0.9770 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 0.6870 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 0.9060 -1.4670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 1.4330 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 1.7600 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -1.1370 3.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 1.2730 3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 0.0230 4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.3830 5.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -2.6870 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -4.5510 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -4.9870 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 -3.6220 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 5.1860 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 4.2670 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 4.1140 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 4.8350 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 6.6940 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 5.9820 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5550 8.4320 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 8.8220 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 7.7720 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 8.4360 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 5.5720 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 6.0290 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 0.7620 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 0.2540 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 1.5890 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 2.1780 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 2.0450 6.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 6.1990 1.7820 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2260 6.8350 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 33 2 0 0 0 0 12 13 1 0 0 0 0 12 18 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 58 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 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END