CHEMBRIDGE-ZINC04178331 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -1.3210 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 -1.8010 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -1.4850 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -0.6860 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -0.2130 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 -0.2520 2.5050 Br 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -1.9550 0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6800 -2.7710 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 -3.1970 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7340 -2.8370 0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7080 -3.9770 -1.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1070 -4.4040 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1750 -5.9250 -1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5530 -6.2940 -3.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1260 -5.9440 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9770 -4.4190 -3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7390 -7.6440 -3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2210 -8.1890 -4.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4130 -9.5340 -4.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1190 -10.2920 -3.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6050 -9.6870 -2.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -1.5670 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 -2.4220 -1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 0.4050 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5850 -2.2020 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 -3.6540 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4620 -4.1350 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7250 -3.9200 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6410 -6.4100 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2160 -6.2450 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6210 -6.4290 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6830 -6.2790 -4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3940 -3.9360 -3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9230 -4.1600 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6770 -7.5690 -5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0230 -9.9840 -5.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2870 -11.3450 -4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1540 -10.2730 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4020 -8.4020 -2.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 50 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 M END