PUBCHEM-ZINC00674714 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 65 0 0 0 0 0 0 0 0999 V2000 0.2340 2.3780 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 2.6330 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 1.6630 3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 1.8980 4.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 3.1080 4.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 4.0760 3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 3.8370 2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 5.1600 0.9450 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 3.3670 5.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 3.6320 5.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 4.5870 6.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 0.9450 5.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -0.2760 4.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -1.2050 6.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.8560 7.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -2.4230 6.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -3.3220 7.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -2.8550 8.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -3.7450 9.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -5.1000 9.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -5.5690 7.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -4.6850 6.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -6.2330 10.5170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -7.3940 9.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -5.4920 11.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -6.6860 10.9410 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -7.4060 10.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -7.7920 10.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 -8.5120 9.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 -8.8070 8.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -8.4240 7.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -7.7320 8.8500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -8.7440 6.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 -9.4870 5.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 -8.9090 9.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7420 -9.6450 8.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 2.7100 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 2.9290 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 1.3120 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 0.7220 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 5.0180 3.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 2.4960 6.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 2.7630 5.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 4.5020 5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 3.8190 6.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 4.3980 6.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 4.7740 7.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 5.4580 5.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.0650 4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -0.7460 4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -2.6770 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -1.7960 8.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -3.3820 10.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -6.6290 7.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -5.0520 5.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -6.4480 11.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -7.5380 11.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -9.6760 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -10.4360 6.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -8.9150 5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7380 -9.9010 9.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8290 -9.0380 7.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1940 -10.5590 8.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 40 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 9 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 35 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 35 36 1 0 0 0 0 36 61 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 M END