IBS-ZINC05245922 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 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 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -1.9270 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -2.6690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -3.1150 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -3.9130 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -4.1500 -0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -4.3630 2.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 -4.5590 0.0030 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 0.2580 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5420 1.3110 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9550 1.5710 -2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2490 2.3870 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7440 3.6110 -4.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0850 3.8860 -5.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4140 2.6530 -6.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3660 1.6810 -6.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0180 1.3840 -4.8890 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 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 -2.4280 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -2.2120 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -3.7160 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -4.1730 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -4.8760 1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 -0.3040 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 1.2020 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3800 2.2620 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3300 0.7560 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1670 2.1250 -3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1160 0.6200 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0380 1.8320 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0880 3.3380 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4380 4.5390 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6210 3.2090 -3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9370 4.5640 -5.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2260 4.3380 -6.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6980 0.7650 -6.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4860 2.0700 -6.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8830 0.9460 -4.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1820 0.6860 -4.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 0.5270 -1.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 0.9910 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6460 2.6360 -4.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 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 28 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 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 51 1 0 0 0 0 49 50 1 0 0 0 0 M END