NCID-ZINC05461936 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0770 -0.0330 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -1.4250 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.3870 -0.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -1.6010 -0.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -2.9540 -0.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9680 -3.6210 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -2.9360 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -2.3190 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -1.0740 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 -1.1810 1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -0.0320 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 1.2180 2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 1.3170 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5650 0.1710 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0860 0.3180 -0.3220 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.4130 2.5420 0.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 3.1770 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 2.3440 2.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 2.8480 3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -0.1380 3.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.0710 2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -2.5280 2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -3.4300 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -4.7100 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -5.4660 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -6.6450 2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -5.0720 3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 -3.8340 4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -2.7570 3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -5.9980 4.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -5.5870 6.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -0.0900 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 0.4750 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 0.5230 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -0.8320 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -2.3520 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -3.9570 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 -2.0630 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 -3.0370 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 3.4020 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 2.5120 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 4.1020 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 3.7910 4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 3.0100 3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 2.1260 4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.8280 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 0.9160 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.2520 3.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -5.2480 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -3.6990 5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -1.9020 4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -4.7580 6.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -5.2680 6.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -6.4220 6.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 29 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END