PUBCHEM-ZINC02032036 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.3870 0.5950 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 1.0280 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 2.9450 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 3.4600 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 4.9190 -0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 5.7630 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 5.2170 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 6.0340 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 7.4100 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 7.9770 -1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 7.1760 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 7.7620 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 9.0830 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 10.3900 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 11.4800 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 11.3050 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3610 10.0300 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 8.9470 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 7.6100 1.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 7.2100 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 6.8880 0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 5.4610 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 4.7670 1.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 13.0680 -0.2670 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -0.4520 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 0.7960 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 0.8350 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.2020 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -0.0320 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 1.6180 3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 3.1230 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 3.4420 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 3.1050 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 3.0410 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 4.1530 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 5.5940 -2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 8.0470 -2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 9.0550 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 10.5710 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 12.1610 1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 9.8880 2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 1.4530 1.3430 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8460 1.2820 1.4790 H 0 0 0 0 0 0 0 0 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 1 42 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 42 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 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END