PUBCHEM-ZINC01421216 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 1.6290 -2.2590 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -1.8480 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -2.4630 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -2.0860 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -1.0940 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -0.4770 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -0.8490 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -0.2390 -2.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -0.8220 -3.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 0.6040 -0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -0.6870 1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.8730 2.6110 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -3.8630 2.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -1.8320 3.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -3.6850 2.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -4.7970 1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -5.6020 2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -6.7460 1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -7.9820 1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -8.7500 0.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 -9.6780 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -8.0080 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -6.7230 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 -5.7480 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -6.0530 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 -7.3230 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1480 -8.2940 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1970 -4.7360 -1.5630 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -8.4520 2.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -3.0660 -2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -1.4060 -2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -2.6000 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -3.2380 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -0.8260 -3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -0.2390 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -1.8450 -3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 1.5730 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 0.6000 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 0.4190 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 0.1810 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -0.4350 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -1.5120 2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -3.4250 3.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -4.4050 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -5.4430 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -5.9940 3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -4.9570 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 -4.7590 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6810 -7.5510 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 -9.2780 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -8.8630 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -9.2220 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -7.6120 2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M END