PUBCHEM-ZINC03678459 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 -0.0540 1.2510 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -0.1730 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -0.6910 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.0620 2.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -2.2050 1.0760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5000 -2.6250 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -2.6420 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -4.0820 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -4.9760 -0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 -4.8570 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 -5.9740 -2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -7.1950 -1.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 -7.3370 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -6.2120 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -6.0690 1.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -6.8170 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -4.7800 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -4.2390 2.5990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2030 -4.5720 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -4.6300 3.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -5.0790 4.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -5.3840 6.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -5.2450 6.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -4.8070 5.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -4.4970 4.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -5.5640 7.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -5.3730 8.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 -5.6600 9.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 -6.8570 10.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 -7.1170 11.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -6.1880 12.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 -4.9980 11.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 -4.7350 10.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 1.7280 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 1.5520 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 1.5670 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.4670 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -2.0370 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -3.9120 -2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -5.8860 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -8.0510 -2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 -8.2900 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -5.1930 4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -5.7280 6.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -4.6920 5.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -4.1530 3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 -6.0500 7.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 -4.3380 8.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 -7.5980 9.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 -8.0480 11.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -6.3930 13.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -4.2760 12.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -3.8080 10.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -2.7390 2.4830 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6870 -2.3480 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -2.3570 3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 54 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 54 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 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 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 M CHG 1 54 1 M END