CHEMBRIDGE-ZINC04562384 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.2480 1.5770 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.0650 0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0430 -0.1460 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.4620 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -0.7160 -2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -1.2000 -3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.4290 -3.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -1.1750 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -0.6870 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -0.5850 1.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.6870 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -0.2780 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.3810 3.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -0.8910 4.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -1.2960 4.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -1.2010 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -1.6430 3.3810 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4580 -2.6260 3.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -1.0230 2.6780 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.3010 0.0300 3.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 -0.1660 5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 0.3680 5.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 -0.1380 2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1510 -0.6720 2.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 1.7880 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 2.0610 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 1.9580 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -0.5360 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -1.3980 -4.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -1.8080 -4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -1.3550 -2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -0.4850 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -0.9460 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 0.1180 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -0.9700 5.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -1.6920 5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -1.2280 5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 0.3740 5.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6130 0.1980 6.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 1.4360 5.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5920 0.9240 2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -0.6770 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -0.5020 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1450 -1.7400 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0810 -0.3330 4.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1510 -1.3150 4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 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 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 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 34 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 45 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END