PUBCHEM-ZINC05897294 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -2.0930 0.8470 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -0.0370 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 -0.0560 0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -0.8530 1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -1.6440 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -1.6290 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -0.8480 -1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -0.7790 -2.7470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -1.6770 -3.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -3.3410 -3.6360 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -0.9640 -5.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -1.4190 -6.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -2.5710 -6.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -0.2720 -7.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.7180 -8.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 0.1940 -9.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 1.5410 -9.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 2.3900 -10.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 1.8940 -11.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 0.5550 -12.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.3050 -10.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -1.7490 -11.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 2.9410 -13.1740 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 -2.4760 0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -3.1020 0.1040 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7210 1.6580 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 0.2650 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 1.3030 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 0.5530 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -0.8490 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -2.2110 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 0.0320 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 0.0370 -4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 0.5110 -7.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 0.1010 -7.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 1.9670 -8.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 3.4340 -10.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 0.1780 -13.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -1.9830 -10.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -1.9760 -12.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -2.4010 -10.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -2.4790 2.2290 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 2 0 0 0 0 M CHG 1 25 -1 M END