PUBCHEM-ZINC03739903 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0710 1.2860 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -0.1060 -0.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -0.6570 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 0.0420 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -0.6450 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -2.0310 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -2.7400 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -2.0480 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -4.1860 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -4.9510 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 -6.3400 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -7.6060 -0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -8.7980 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -8.7590 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 -7.5350 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -6.3510 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -5.0450 0.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -4.7620 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -7.5050 2.4760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 -7.6590 -2.2520 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -4.3830 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 -4.2010 -3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 -3.5830 -4.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 -3.3910 -5.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 1.5550 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 1.8760 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 1.5230 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 1.1200 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 -0.0980 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3140 -2.5510 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -2.5890 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -9.7570 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -9.6900 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 -5.0100 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 -3.4110 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 -3.5580 -2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 -5.1660 -3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 -4.2300 -4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -2.6170 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -2.7170 -5.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -4.3430 -5.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 -2.7730 -6.4670 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2180 -2.6440 -7.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -1.8490 -6.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 -3.3580 -6.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 21 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 20 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 42 1 M END