IFLAB-ZINC00674588 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -2.6920 -8.0720 -3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -7.1780 -2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -7.5630 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -6.7400 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -5.5310 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -5.1490 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -5.9750 -3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -5.4540 -5.2180 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -7.1170 0.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -6.2190 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -6.8000 2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -7.8770 3.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -6.1240 3.8310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -6.6160 5.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -7.9850 5.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -8.4680 6.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -7.5900 7.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -6.2260 7.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -5.7360 6.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -8.2100 9.3720 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -7.1980 10.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -9.5370 9.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -8.3340 9.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -7.1930 10.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -7.1790 10.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -5.9980 10.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 -4.9680 10.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -5.6000 9.7720 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -7.8210 -4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -7.9310 -4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -9.1130 -3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 -8.5050 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -4.8880 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -4.2080 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -6.0710 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -5.2620 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -5.2950 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -8.6720 4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -9.5330 6.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -5.5420 8.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -4.6710 6.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -9.2050 10.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9640 -5.8760 10.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -3.9280 10.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 M END