PUBCHEM-ZINC03662162 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.7900 1.1860 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -0.3030 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -0.8000 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -1.2010 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 -1.6270 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -2.0220 -3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -1.9940 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2730 -1.5690 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -1.1800 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 -2.3830 -3.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2860 -2.3290 -3.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2520 -2.8010 -4.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -0.8880 1.5900 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -1.9830 1.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -0.7910 2.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 0.5610 2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 1.5290 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 2.6700 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 2.8380 2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1290 1.8700 3.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4430 0.7210 3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 -0.1320 4.4890 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 0.4530 5.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 1.8000 5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -1.3190 4.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -1.6490 3.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -2.2380 5.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 3.9970 0.2140 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 1.5740 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 1.3180 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 1.7250 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.8530 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -0.4440 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -1.6480 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 -2.3530 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3030 -1.5470 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 -0.8540 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3770 -2.9770 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5280 -1.3040 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2740 -2.7600 -3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1610 -2.1540 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0100 -3.8260 -4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 1.3970 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 3.7280 3.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 -0.1970 6.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 0.6190 6.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 2.6280 5.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5180 1.8090 5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -2.9020 5.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -2.8300 5.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 -1.6450 6.5490 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 13 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 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 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M END