PUBCHEM-ZINC04771755 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 68 0 0 0 0 0 0 0 0999 V2000 4.2320 9.0440 -2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 9.9080 -3.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 10.7160 -4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 10.6510 -4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 9.7840 -3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 8.9820 -2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 8.0370 -1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 8.7500 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 7.7910 0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 8.4930 1.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 9.6460 2.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 7.8380 2.9100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 8.5210 4.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 9.8600 4.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 10.5320 5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 9.8690 6.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 8.5310 6.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 7.8570 5.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 10.5310 7.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 9.7870 8.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 10.6930 10.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 9.8960 11.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 10.7880 12.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 10.8940 12.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 11.6910 13.9910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 12.3790 14.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 12.3040 14.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 11.5220 13.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 11.4430 12.6980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 13.1980 15.6460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 10.1780 12.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 11.5930 -5.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 11.2320 -6.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2990 10.1840 -5.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3360 12.1320 -7.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9670 11.3120 -7.9260 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 8.4130 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 9.9570 -3.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 11.2780 -5.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 9.7340 -3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 7.7170 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 7.1670 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 9.0700 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 9.6200 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 7.4700 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 6.9210 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 6.8950 2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 10.3760 3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 11.5730 5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 8.0160 7.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 6.8140 5.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 8.9460 8.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 9.4160 8.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 11.5340 10.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 11.0640 9.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 9.0540 11.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 9.5250 11.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 10.8750 11.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 11.9570 13.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 13.2630 15.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 13.7070 16.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 9.5980 11.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 10.2560 12.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 12.4600 -5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6090 12.2700 -7.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5810 13.0990 -6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 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 47 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 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 31 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 32 64 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 36 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 M END