PUBCHEM-ZINC04670898 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.6140 0.3500 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -0.8640 -0.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -1.1040 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -0.1970 1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -0.5320 3.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -1.7890 3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -2.6970 3.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -2.3580 1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -3.2600 1.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -3.9970 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -4.5960 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -3.8010 -1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -4.3760 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -5.7340 -2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -6.5400 -2.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -5.9500 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -6.5250 -3.9990 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 0.4700 4.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 2.1420 6.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 2.3110 7.1270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2800 2.9810 6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 2.8150 8.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 4.1520 8.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 4.6330 10.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 3.7870 10.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 2.4580 10.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.9740 9.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 1.0180 7.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 0.4220 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 0.3460 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 1.2150 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 0.7860 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -2.0710 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -3.6620 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -3.3710 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -4.7860 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -2.7350 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -3.7750 -3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -6.6270 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -0.0340 4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 1.2110 3.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 3.0800 5.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 1.6500 6.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 4.8350 8.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 5.6710 10.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 4.1630 11.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 1.7970 11.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 0.9320 9.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 1.0280 8.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 1.2090 5.0110 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8460 1.6930 4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 0.5410 5.5870 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 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END