KEYORGANICS-ZINC04105463 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.0380 1.3310 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 0.0070 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.6160 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 0.0830 -0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4130 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 2.0350 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 2.1250 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 3.4700 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 4.0680 -0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7260 4.1510 -0.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 5.6220 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 6.1060 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8670 5.4730 -1.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7620 4.0140 -1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 3.4440 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6820 6.0080 -2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9820 5.5370 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7820 6.0790 -3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2530 7.0780 -4.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9540 7.4970 -4.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 -0.7690 -0.9930 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 1.8150 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5420 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -1.6500 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 3.0690 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 1.6500 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 5.9980 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 5.9800 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 5.8360 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 7.1890 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 3.7730 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 3.5800 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5990 3.5970 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8290 2.3790 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3620 4.7590 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7950 5.7330 -3.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8520 7.5220 -5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5390 8.2740 -4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2120 6.9590 -3.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 39 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 M END