IBS-ZINC04811828 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7080 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1040 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7040 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.9920 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6670 -1.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6480 -2.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -4.1120 -2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.5720 -3.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -4.7660 -4.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -5.1870 -5.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -5.4150 -6.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -5.2220 -5.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -4.8040 -4.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.8520 2.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -4.2510 2.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.9520 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -4.2600 4.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -6.4240 3.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -7.0690 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -8.4470 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -9.1910 3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -8.5590 4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -7.1810 4.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -11.0800 3.0440 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1920 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.1380 -3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -4.4780 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -4.5030 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -4.5880 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -5.3380 -6.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -5.7430 -7.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -5.3990 -6.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -4.6570 -3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.4060 3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -4.1070 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -4.8760 5.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -3.2950 4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -6.4900 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -8.9460 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -9.1450 5.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -6.6890 5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 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 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 M END