NIH-ZINC02602887 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0580 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.7120 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.0960 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.6980 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -1.9920 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.6670 -1.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.8350 -2.7050 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -1.4200 -3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -1.9140 -5.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -3.1040 -5.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -1.0310 -6.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -1.4840 -7.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -2.6930 -7.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -3.1370 -9.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -2.3800 -10.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -1.1770 -9.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -0.7240 -8.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -2.9510 -11.8690 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -2.3180 -12.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -4.3620 -11.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -2.3570 -12.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -0.9910 -12.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 -0.4230 -13.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 0.8950 -13.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 1.4670 -12.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 0.1930 -12.3020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -2.9070 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 1.8870 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 1.8600 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 1.8510 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.1950 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.8340 -3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -0.7980 -3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -0.0820 -6.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -3.2840 -7.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -4.0770 -9.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -0.5890 -10.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 0.2180 -8.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -2.9660 -13.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 1.4640 -14.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 2.5270 -12.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -3.1230 2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -3.8420 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -2.3420 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 M END