IBS-ZINC00706890 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0410 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -2.8620 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -4.1600 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -4.1460 -0.6460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -4.9230 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -2.8050 -1.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -5.2120 1.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -4.9590 2.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -3.7210 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -2.4860 2.5830 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6280 -1.7210 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -1.9640 2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -0.6780 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 -0.1990 3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 -1.0040 3.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 -2.2900 3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -2.7680 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 -3.3940 3.0460 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -3.5760 4.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -3.4600 5.8730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -6.0220 3.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -0.0480 3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 0.8060 4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2000 -0.6300 3.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 -3.7700 2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -6.9220 3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -5.8710 4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 35 1 0 0 0 0 22 23 3 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 M END