CHEMDIV-ZINC05662453 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 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 3 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -0.9110 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -1.3690 2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -1.4200 3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -1.0080 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.5470 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -1.9110 4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -1.9620 5.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -2.4200 7.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 -2.8280 6.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 -2.7790 5.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 -2.3290 4.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -0.6430 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -0.3410 -2.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -1.1540 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 -1.2960 -2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -1.7800 -2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9900 -2.1050 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2910 -1.9610 0.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -1.5100 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4690 -1.9940 -3.8430 Br 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 2.5520 -0.8710 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -1.6870 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -1.0450 4.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -0.2230 2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -1.6430 5.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -2.4600 7.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 -3.1850 7.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8070 -3.0980 5.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 -2.2960 3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.7520 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 -1.0340 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0000 -2.4830 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -1.4100 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 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 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 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 39 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 41 1 0 0 0 0 M END