IBS-ZINC02209432 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 0.3170 1.2360 -2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -0.1310 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -0.7980 -1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -0.1020 -0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 1.2880 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 1.9440 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 1.9840 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 1.3360 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 -0.0230 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -0.7760 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 -2.2140 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 -2.7500 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 -4.2080 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -4.9370 -0.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 -4.7400 -0.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6240 -6.1880 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1110 -6.5250 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3040 -8.0370 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7270 -8.3600 -0.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3950 -8.6490 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6770 -8.8840 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7900 -8.7430 -0.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6250 -8.4350 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 -1.9140 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 -2.0480 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6160 -2.9440 1.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9680 -1.1070 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7300 -1.2430 2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7600 -0.3610 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0380 0.6580 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2860 0.8000 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2570 -0.0810 0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6740 2.1960 -0.4180 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 1.7420 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -0.6700 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -1.8580 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 3.0030 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 3.0440 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 1.8970 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3050 -0.5020 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9870 -2.8460 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2060 -4.1630 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0650 -6.6940 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 -6.5180 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6700 -6.0180 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4730 -6.1950 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 -8.5440 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9420 -8.3680 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9740 -8.6810 2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4750 -9.1410 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4140 -8.2660 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3620 -1.2380 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5140 -2.0370 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3500 -0.4650 3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8450 1.3470 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6730 0.0280 -0.3740 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 24 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 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 27 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 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 32 56 1 0 0 0 0 M END