NIH-ZINC00470732 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2180 -0.6720 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 0.0430 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 1.4430 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 2.1020 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 1.9930 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 3.1930 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 1.1300 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -0.3950 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 -0.9860 -1.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -1.0000 1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 1.4570 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 1.6850 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1630 2.0210 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7650 2.0740 0.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8080 2.2640 2.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2360 2.5910 2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7110 2.8150 3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2020 1.8720 4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5210 2.5170 5.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2060 3.8150 5.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7210 3.9910 4.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.8990 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.5600 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -1.7510 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 3.1820 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 0.6330 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 2.3620 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 2.5090 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5330 0.7800 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3260 2.2220 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7940 1.7660 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3970 3.4960 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3280 0.8230 4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9380 2.0550 6.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3260 4.5870 6.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 M END