CHEMDIV-ZINC02459204 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.1140 1.7760 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 0.2660 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -0.3310 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 0.3910 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -1.6670 -0.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -2.6480 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -4.0180 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -3.6970 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -2.3220 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 -1.7820 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1680 -2.6100 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0180 -3.9830 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -4.5240 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5190 -5.1160 0.2180 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -0.0360 0.0730 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 0.3640 1.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 0.4920 -1.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 0.2590 0.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4760 0.1370 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3740 1.0970 1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9480 0.9760 3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6270 -0.1040 4.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7290 -1.0630 3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 -0.9470 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1920 -0.2220 5.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8160 -1.3590 6.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5470 -1.3210 7.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 2.1950 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 2.2370 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 1.9730 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 0.0710 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -0.1830 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -2.4940 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -2.5730 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -4.5390 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -4.6180 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1440 -2.1860 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -5.5950 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4390 0.5160 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6240 1.9380 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6470 1.7220 3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4790 -1.9030 4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -1.6960 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0830 -2.2710 5.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7390 -1.3420 6.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2790 -0.4090 7.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6230 -1.3380 7.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2600 -2.1880 7.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END