NIH-ZINC04034970 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.6160 1.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6720 -1.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -0.0450 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -1.2130 -3.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -2.4530 -2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.0640 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -3.0440 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.3800 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.7580 -1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -3.7930 -2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -6.4660 -2.4090 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -6.5380 -3.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -7.1510 -1.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -6.9700 -2.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -6.4180 -3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 -7.2920 -3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -6.7230 -4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -5.7180 -5.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6880 -7.3320 -5.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5860 -6.7940 -6.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9500 -7.9260 -7.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4880 -9.0610 -6.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4810 -9.6140 -5.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 -8.5550 -4.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9800 -10.0440 -7.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5340 -11.2040 -6.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0200 -12.1730 -7.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9360 -11.9490 -8.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3740 -10.7750 -9.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 0.5520 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 0.5760 -2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -1.1950 -4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -1.1700 -4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.7550 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -5.1330 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -4.0870 -4.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -7.6320 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -5.4040 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -6.3980 -4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 -8.3050 -3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -7.3120 -2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4910 -6.4060 -5.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -5.9960 -6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7020 -7.5740 -7.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0590 -8.2420 -7.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8920 -10.4860 -4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5960 -9.9060 -5.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2650 -8.9200 -3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 -8.3400 -3.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5840 -11.3450 -5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4550 -13.0830 -7.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3060 -12.6860 -9.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3060 -10.5970 -10.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9230 -9.8650 -8.4160 N 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 27 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 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 59 2 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M END