PUBCHEM-ZINC06593683 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 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 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8260 -2.4140 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -2.5840 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -3.0880 -1.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 -3.4950 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1390 -3.3060 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 -2.5950 1.1640 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 -4.0940 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5000 -4.4460 -2.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 -4.2530 -3.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -4.8490 -4.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -4.9130 -5.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 -6.0300 -5.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -6.0890 -7.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -5.0320 -7.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -3.9140 -7.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -3.8580 -6.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -2.4670 -8.9460 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 0.5120 -0.3560 -0.8950 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1460 -3.5640 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -3.9730 -3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8060 -5.8560 -4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3640 -4.2400 -4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 -6.8560 -5.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -6.9620 -7.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -5.0780 -8.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -2.9880 -6.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -2.2400 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -2.5520 1.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -3.5570 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 38 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 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 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 M END