PUBCHEM-ZINC00645568 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 1 0 0 0 0 0999 V2000 -0.0820 1.4720 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0340 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.6720 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -2.1720 1.2950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0230 -2.4580 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.7590 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -2.0600 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.8720 -2.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -4.0990 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -4.0660 -0.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -5.2890 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -5.3150 -3.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -6.5450 -4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -7.5200 -3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -6.8880 -1.9240 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -0.7070 -1.1840 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -2.6730 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -2.4280 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -2.8860 1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -3.5890 3.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 -3.8360 3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -3.3800 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -4.5270 4.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 -4.9700 5.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 0.1010 2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 0.3660 2.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 0.5430 2.9850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 1.3800 4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 1.2190 4.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 2.0720 6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 3.0480 6.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 3.1730 5.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 2.3870 4.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 1.8710 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 1.8120 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 1.8210 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -4.4420 -4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -6.7070 -5.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -8.5400 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -0.2550 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -1.8780 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 -2.6930 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3670 -3.9460 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -3.5750 3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -5.5060 6.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -4.1080 5.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9330 -5.6320 4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 0.2810 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 0.4490 4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 1.9770 6.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 3.7150 7.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 2.5240 3.6340 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 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 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 33 52 1 0 0 0 0 M END