PUBCHEM-ZINC03122957 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 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 0.5980 -0.6000 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 0.0700 -1.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.1040 -1.1200 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1950 -2.4910 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -2.6700 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -4.1750 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -5.0090 -2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -6.3060 -1.7080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -7.0850 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -6.3390 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -5.0050 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -4.7300 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -5.7580 2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -7.0740 1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -7.3700 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -2.5030 -2.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 -3.2100 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -3.6110 -3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -4.3740 -3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 -4.7460 -4.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -4.3670 -5.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 -3.6130 -5.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -3.2350 -4.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 -3.2120 -7.2370 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3630 -3.5480 -8.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -2.5470 -7.3130 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -2.3000 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -2.3540 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -4.7020 -3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -3.7070 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -5.5440 3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -7.8760 2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -8.3970 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -3.5050 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 -4.6710 -2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 -5.3360 -4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 -4.6630 -6.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -2.4990 -4.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -1.5440 -4.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 18 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 39 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 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END