NIH-ZINC00266812 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 1.8720 0.3350 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.5610 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -1.0380 -1.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -1.8930 -1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -2.2930 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -3.1530 -2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -3.6090 -3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -3.2150 -3.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -2.3640 -2.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 -1.9600 -3.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -2.3930 -4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -3.7590 -4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -4.1950 -5.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5230 -3.2770 -6.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 -1.9030 -6.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 -1.4540 -5.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -0.0900 -5.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 1.0170 -5.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 1.0430 -6.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 2.2930 -5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3770 -3.7620 -7.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -2.8830 -8.5470 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8120 -0.2190 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 1.1730 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 0.7300 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -1.4000 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 0.0230 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -1.9520 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -3.4620 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -4.2700 -3.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -3.5720 -4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -1.2640 -2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -4.4960 -4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 -5.2620 -5.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 -1.2010 -7.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 0.0680 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 2.5020 -4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 3.1240 -5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 2.2010 -5.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5450 -5.0190 -7.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 2 0 0 0 0 M CHG 1 22 -1 M END