PUBCHEM-ZINC03114561 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.3950 1.6850 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 0.3050 -1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -0.4550 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 0.1700 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 1.5610 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 2.3110 -0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 -0.6410 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 -1.9150 0.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 -2.7080 0.5880 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 -4.2720 1.0830 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 -4.8450 1.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -4.2250 2.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 -5.1260 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -5.7570 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -6.4270 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -6.4650 -2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -5.8330 -1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -5.1680 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -7.3810 -3.7080 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 -0.0070 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 -0.2910 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9790 0.3220 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 1.1640 0.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7510 1.4590 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 0.8870 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 2.2760 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -0.1770 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -1.5320 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 2.0510 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 3.3880 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 -2.3400 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4200 -5.7260 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 -6.9200 -3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -5.8630 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -4.6780 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3860 -0.9780 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5730 0.1090 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1630 2.1540 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 1.1300 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M END