NIH-ZINC00379564 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 0 0 0 0 0 0999 V2000 0.3240 1.4950 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.0100 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -0.7610 0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -2.1400 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -2.7740 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -2.0170 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -0.6370 -0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 0.3110 -1.8840 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1680 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -4.9100 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -4.9830 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -4.4680 0.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -4.9830 -1.3760 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -6.1460 -1.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -4.0140 -2.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -5.4230 -1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 1.8410 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 1.9120 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 1.8200 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 -0.2690 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -2.7260 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -2.5060 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -5.9190 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -4.4010 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -5.9210 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -6.0930 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -4.5190 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -5.6200 2.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -5.6400 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 11 28 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 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 28 29 1 0 0 0 0 M END