CHEMDIV-ZINC02697186 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4830 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0060 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -0.6670 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -2.0550 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.7320 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.0810 -0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -0.7270 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -0.3510 0.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -1.4270 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -2.5150 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 -1.4280 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4410 -0.2370 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8200 -0.2400 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5140 -1.4300 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 -2.6200 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4430 -2.6200 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9120 -1.4320 0.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5920 -0.3700 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9950 0.5450 -0.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0640 -0.3200 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7720 0.7780 -0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1450 0.8190 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8220 -0.2260 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1260 -1.3170 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7540 -1.3730 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7060 -0.1610 0.1610 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8570 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.9720 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 1.6970 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -0.1280 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -2.5830 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -3.7980 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -3.5320 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 0.6880 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3600 0.6830 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3640 -3.5440 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 -3.5440 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3930 -2.1960 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2440 1.5930 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6930 1.6680 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6600 -2.1290 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2120 -2.2270 0.7570 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 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 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 41 1 0 0 0 0 25 42 1 0 0 0 0 M END