NIH-ZINC02886765 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -0.7000 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -0.5460 -0.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 -1.1780 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -1.1910 -3.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0740 -0.5030 -4.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.7250 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -0.5950 -2.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -2.8700 -3.9490 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -2.6320 -4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -1.3600 -5.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -1.1760 -5.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 -2.2560 -6.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 -3.5270 -6.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -3.7200 -5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -5.0050 -5.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -0.4830 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -2.1800 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -0.5150 -4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -0.1860 -5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -2.1060 -6.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -4.3680 -6.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -5.1390 -4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -5.7610 -5.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 M END