PUBCHEM-ZINC04658257 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 65 0 0 0 0 0 0 0 0999 V2000 -0.2280 1.3500 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -0.1340 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -0.9850 1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -2.3440 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -2.8600 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -1.9960 -0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -0.6390 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -4.3170 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -5.0210 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -6.4840 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -7.2580 0.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -8.5480 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -9.7560 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -10.9390 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -10.9620 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -9.7870 -1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -8.5720 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -7.2570 -1.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -6.7750 -2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -6.5450 -3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -7.5680 -4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -7.3570 -5.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -6.1220 -5.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -5.0980 -5.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -5.3080 -3.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -5.8320 -7.4440 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -5.0060 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -6.1740 -0.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -4.3390 0.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -5.0580 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -5.4380 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -6.1700 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 -6.5230 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -6.1460 1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -5.4090 1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 -7.3200 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 1.8090 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 1.7860 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 1.5290 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -0.5850 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -3.0080 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -2.3880 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 0.0310 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -4.5010 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -9.7510 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -11.8680 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -11.9070 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -9.8120 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -7.5180 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 -5.8400 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 -8.5330 -4.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -8.1570 -6.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -4.1330 -5.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -4.5070 -3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 -5.1630 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -6.4660 -1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 -6.4230 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -5.1110 2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 -6.6410 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1530 -7.9390 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3540 -7.9570 -0.0050 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 41 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 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 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 55 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 57 1 0 0 0 0 35 58 1 0 0 0 0 36 59 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 M END