IBS-ZINC05246268 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1590 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.4550 -3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.8350 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.6060 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.9960 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.7520 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -3.1300 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -3.9580 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -4.2010 1.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 -4.4290 0.9710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -4.4930 -2.3140 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 0.3800 -4.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 1.4800 -4.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 1.7550 -4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9620 2.6560 -5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 3.4620 -6.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9660 4.7510 -6.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 4.7040 -6.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 3.9110 -5.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2370 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -2.3110 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -2.2350 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -3.7140 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -4.2350 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -4.9630 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -0.1640 -5.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 1.3180 -4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 2.4240 -5.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3840 0.9430 -5.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9190 2.2910 -3.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4160 0.8100 -4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3890 1.6530 -5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1720 3.1510 -4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6520 3.5770 -6.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4200 2.9380 -7.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 5.7180 -6.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 4.2170 -7.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 4.4260 -4.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 3.8240 -5.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 0.6650 -3.9130 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 1.1120 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5090 2.5690 -5.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 46 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 48 1 0 0 0 0 46 47 1 0 0 0 0 M END