KEYORGANICS-ZINC00166189 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.2870 0.3550 0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -0.9060 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -1.8550 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -0.5550 -1.3480 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7330 0.1720 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -1.8370 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -2.2340 -3.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0310 -2.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 1.2880 -3.3420 S 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 1.2080 -3.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 1.4150 -4.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 2.6560 -2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 3.3770 -1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 4.4560 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 4.8210 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 4.1110 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 3.0250 -1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 2.2020 -2.5010 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 1.0560 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 0.8670 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 0.1020 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -1.4150 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -1.4080 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -2.7970 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -2.1020 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -0.8480 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 3.1040 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 5.0090 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 5.6570 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 4.4070 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -2.3140 -1.3530 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 M CHG 1 31 -1 M END