KEYORGANICS-ZINC01391956 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.0290 1.5320 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0020 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7440 -0.5060 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 0.2480 1.3050 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2070 -0.2400 0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 1.6400 1.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -0.4220 2.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -1.5940 2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 -2.1190 3.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -1.4720 5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 -0.2980 5.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 0.2290 3.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 -2.1900 6.6090 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -0.5270 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -0.8360 1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -0.6570 -1.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 -1.2390 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -1.0320 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4800 -1.6070 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8800 -2.3880 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 -2.5960 -2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -2.0190 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2500 -3.0150 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1620 -2.1390 -1.7540 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.2140 -4.2140 -1.8730 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 -3.2720 0.1620 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -0.4500 -1.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 1.9150 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.8940 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.8760 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -0.2380 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -1.5900 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9740 -2.1000 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 -3.0360 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4230 0.2080 6.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 1.1470 4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -0.3480 -1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9130 -0.4230 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1500 -1.4480 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 -3.2070 -3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 -2.1780 -3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -1.4120 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 2 27 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 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 36 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 37 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 27 42 1 0 0 0 0 M END