NIH-ZINC04574689 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 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 0.7410 -0.5110 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -2.0040 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -2.7280 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -2.0470 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -2.6710 -0.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -0.5360 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -4.1900 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -4.8740 0.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -6.3300 0.4860 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5560 -6.6540 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -6.9960 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -6.7000 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -7.3560 -2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -7.9990 -3.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -7.2300 -3.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -6.7220 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -5.8740 1.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -2.6580 2.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.4980 -1.2580 C 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 1.7900 -0.2260 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -0.0560 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -0.2420 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -0.1420 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -4.6930 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -8.0740 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -6.6060 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -5.6220 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -7.0900 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -6.7160 -3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -7.6530 -4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -3.6190 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -0.1220 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -1.5880 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -0.1380 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 -8.0150 1.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -8.2180 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 40 41 1 0 0 0 0 M END