CHEMBRIDGE-ZINC04990285 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1370 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4900 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8700 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -2.6300 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.0080 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -4.1070 2.2240 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9440 -4.6540 3.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -4.7760 1.3420 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4720 0.3340 4.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 1.5720 6.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 1.8600 7.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.3810 6.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -0.6690 5.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 0.8570 8.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -0.3900 9.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -0.5960 10.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -1.7400 11.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -2.6780 11.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -2.4700 10.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -1.3240 9.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 1.2150 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -2.3560 3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -0.2060 4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 1.2850 3.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 2.4930 5.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 1.1800 6.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 2.5730 7.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 2.2780 6.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 0.0110 6.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -1.3020 7.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -1.0870 6.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -1.3820 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 1.1280 8.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 1.6720 9.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 0.1360 11.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -1.9020 12.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -3.5720 11.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -3.2030 9.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -1.1610 8.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -2.7540 0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 0.5810 5.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 0.6100 7.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -2.9610 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 46 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 47 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 48 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 46 49 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END