PUBCHEM-ZINC01079140 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8100 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.6690 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -4.0360 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5490 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -3.6960 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -2.3270 -2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -1.1610 -3.7630 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -5.1270 0.6580 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -6.3520 0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -4.3890 1.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -5.4440 0.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -6.4660 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 -7.5010 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 -8.3810 -2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -8.2510 -2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 -7.2450 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 -6.3300 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -5.2590 0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -4.7260 0.6010 N 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -2.2690 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -5.6180 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -4.0990 -3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -7.6100 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -9.1840 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3610 -8.9540 -2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5160 -7.1540 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 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 28 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 M END