PUBCHEM-ZINC04549559 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 0.3060 2.4330 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 1.0860 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 0.2780 1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.9640 1.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -1.8420 2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -3.0360 3.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -4.0210 3.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -3.8100 4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -2.6260 3.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -1.6430 3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -4.8780 5.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -6.0390 4.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -4.4220 6.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2850 -5.1270 7.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 -6.7950 7.2040 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 -4.2080 7.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4590 -4.3030 9.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 -3.3580 9.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8820 -3.3490 10.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 -4.2740 11.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 -5.2210 11.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 -5.2160 10.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 -6.2270 12.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 -6.9320 13.0930 O 0 5 0 0 0 0 0 0 0 0 0 0 6.9980 -4.1300 13.4720 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 2.3090 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 2.9900 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 3.0350 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 1.2310 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 0.5160 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 0.0980 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 0.8320 2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -3.2020 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -4.9460 3.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -2.4580 4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -0.7390 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -3.4250 6.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2450 -3.3430 7.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7960 -2.6210 8.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6180 -2.6030 11.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 -5.9220 9.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -6.3080 12.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 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 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 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 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 2 0 0 0 0 M CHG 1 24 -1 M END