PUBCHEM-ZINC00704227 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.1420 1.4060 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 0.0160 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -0.6100 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 0.1460 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 1.5460 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 2.1710 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -0.5660 -0.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4210 -1.6400 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 -0.1890 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -0.6660 2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -1.9060 2.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 -0.2690 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8590 -1.0490 -1.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0060 -2.3430 -1.8790 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7740 -2.1710 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4770 -2.5910 -1.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0690 -1.6330 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0410 -0.6150 -0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2940 0.4120 -0.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3740 -1.4970 -0.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1760 -3.7800 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0250 -4.3760 -1.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8020 -4.3070 -3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7020 -5.6930 -3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3620 -6.2240 -4.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1330 -5.3730 -6.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 -3.9910 -5.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5940 -3.4550 -4.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -3.4480 -1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3150 -4.1910 -2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -5.2270 -1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 -5.5300 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3240 -4.8070 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.7780 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -6.8070 0.2490 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 1.8940 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -0.5820 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -1.6960 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 2.1610 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 3.2550 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1580 -0.6740 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 0.8910 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -0.4330 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 0.7890 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4140 -0.6720 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8870 -6.3620 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2810 -7.3000 -5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 -5.7880 -6.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0880 -3.3330 -6.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7090 -2.3780 -4.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 -3.9700 -3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -5.7900 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -5.0210 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7430 -3.2180 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 0.2350 3.2330 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 55 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 M CHG 1 55 -1 M END