KEYORGANICS-ZINC01383712 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.0030 1.4940 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0110 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5820 -0.5190 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.2780 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -1.1320 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -1.0980 -2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -0.2530 -3.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 0.2450 -2.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 0.1230 -5.1050 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 1.3890 -5.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -0.1330 -5.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -1.0370 -5.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -0.7630 -5.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -1.6720 -6.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -2.8570 -7.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -3.1310 -6.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -2.2190 -6.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -4.1020 -7.8210 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 -0.8180 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 -1.4010 1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -1.7260 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 -1.4700 3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -0.8840 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -0.5650 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -0.6320 4.7420 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -1.8180 5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 -2.5500 5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3350 -2.8710 7.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 -2.4680 7.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3660 -1.7420 6.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -1.4100 5.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 1.8660 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 2.0020 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 1.6870 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -1.7150 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 -1.6490 -3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 0.1620 -5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -1.4580 -6.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -4.0560 -7.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -2.4310 -6.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -1.5990 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6490 -2.1790 2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -0.1160 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -2.8650 5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -3.4390 7.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 -2.7220 8.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3690 -1.4310 6.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4090 -0.8390 4.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 1 0 0 0 0 4 8 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 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 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 44 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 31 2 0 0 0 0 30 47 1 0 0 0 0 31 32 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 M END