PUBCHEM-ZINC02976074 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 59 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 0.0510 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 0.7200 1.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -0.1730 2.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 0.4210 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 0.0650 4.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -0.6210 4.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 0.5510 6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 0.2220 7.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 0.6800 8.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 1.4640 8.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 1.7930 7.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 1.3480 6.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 2.0880 10.0760 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -0.1480 -1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 0.6550 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.9100 -2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -1.9170 -2.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 -0.5210 -3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -1.3080 -4.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -0.9400 -5.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 0.2070 -5.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 0.9910 -4.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 0.6310 -3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 0.6030 -7.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5720 -0.5080 -7.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 1.8980 -6.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 0.8220 -8.3150 C 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 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 1.5050 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 0.0410 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.3890 7.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 0.4280 9.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 2.4040 7.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 1.6090 5.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -2.2030 -4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -1.5480 -6.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 1.8850 -4.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 1.2420 -2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 -0.6640 -6.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -0.2210 -8.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -1.4300 -7.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 2.6900 -6.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8930 2.1850 -7.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1370 1.7420 -6.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 -0.1000 -8.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 1.1090 -9.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 1.6140 -8.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 19 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END