IBS-ZINC05206395 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 4.9800 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 6.8560 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 7.2430 -2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1900 7.3430 -1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 7.6980 -3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 7.9540 -4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 7.8520 -4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 7.5020 -3.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 8.1980 -6.1990 Br 0 0 0 0 0 0 0 0 0 0 0 0 -6.3350 8.3020 -5.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5900 9.6970 -5.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 9.8890 -6.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9220 8.9270 -7.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9000 11.1300 -7.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3740 7.7960 -2.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8420 7.5190 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 5.3120 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 5.4260 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 7.3160 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 7.2010 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 7.1440 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 7.4270 -3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0520 10.1020 -4.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 10.2160 -5.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5770 11.9000 -6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4970 11.2540 -7.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9250 7.6340 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5750 6.4980 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3810 8.2150 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 5.3950 -1.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 5.0430 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 44 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 45 46 1 0 0 0 0 M END