PUBCHEM-ZINC04794484 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 -3.7880 0.5660 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 0.6130 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -0.3520 0.1050 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0270 -1.3670 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.3330 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -0.1000 1.5570 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5440 -0.5870 2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 -0.7070 1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 -0.0060 2.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -2.0790 1.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -2.9110 1.8880 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3760 -2.5970 2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7810 -2.7580 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4710 -4.4160 2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -4.6260 1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 1.3100 1.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 2.0590 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 1.6730 2.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 3.3260 2.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 4.2200 3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 5.5720 3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 5.9900 4.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 7.2330 4.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 8.0660 3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 7.6580 2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 6.4150 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 1.1250 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 -0.4630 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3120 1.0260 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 0.3560 -1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 1.6440 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 0.6730 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -0.9990 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -0.6770 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -2.6470 1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6870 -3.3640 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 -1.7170 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 -3.0690 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 1.7710 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 3.8530 4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 4.2950 2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 5.3460 5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 7.5510 5.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 9.0320 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 8.3050 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 6.1020 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4140 -5.2250 2.2200 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 M CHG 1 47 -1 M END