IBS-ZINC02231658 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.6170 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -2.0060 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -2.6310 2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -1.8680 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -0.4700 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 0.1450 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -2.5320 4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -3.7430 4.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -1.7080 5.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -2.8080 6.6030 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -1.6150 7.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -1.9070 8.8760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4810 -2.7920 9.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 -0.7010 9.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 -0.3490 10.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4270 1.0000 10.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 1.9430 10.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 1.5870 8.9550 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 0.3070 8.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -0.3150 7.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2650 1.5020 12.3510 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -2.5930 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -3.7090 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 0.1230 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 1.2230 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -1.0670 4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -1.0920 5.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6790 -1.1040 11.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 2.9930 10.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 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 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 1 0 0 0 0 14 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 33 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 M END