IBS-ZINC00494672 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 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 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 1.7920 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 2.2520 -2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 2.4880 -3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 2.2570 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 1.8200 -2.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 2.5650 -4.6550 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 3.1800 -5.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 2.9640 -5.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 2.9340 -4.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 3.3830 -6.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 3.7910 -7.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 4.1800 -8.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 4.1700 -9.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 3.7680 -8.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 3.3770 -7.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 2.9880 -6.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 3.7600 -9.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 4.1780 -10.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 1.4500 0.4560 Br 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 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 2.4210 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 3.8010 -7.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 4.4940 -9.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 4.4760 -10.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 2.0410 -6.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 5.2040 -10.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 4.1240 -11.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 3.5250 -11.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 M END