IFLAB-ZINC05258444 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.2760 1.0370 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.2090 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -0.6930 0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 0.0660 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 1.3170 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 1.8000 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 2.0890 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 3.4290 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 3.9750 -0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 4.2490 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 5.7300 -0.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8580 5.8660 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8090 6.5380 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2000 7.3380 0.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 7.5880 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 7.9800 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 7.7700 3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 6.3080 3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 5.9640 2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -0.5970 1.4750 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 1.4100 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -0.8040 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -1.6660 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 2.7720 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 1.6600 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5730 4.1000 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 3.9370 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 7.7220 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 8.2180 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 9.0280 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 7.3590 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 8.4190 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 8.0070 4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 6.1620 4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 5.6600 3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 6.6020 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 4.9200 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 6.3680 -1.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 6.1810 0.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2710 6.9090 -1.8790 H 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 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 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 39 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 39 1 0 0 0 0 38 40 1 0 0 0 0 M END