PUBCHEM-ZINC03688255 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.2510 1.8300 -0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 0.3520 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -0.1550 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -1.5410 1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -2.4370 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -1.9010 -0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -0.5290 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -2.9490 -1.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -2.8490 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -4.1460 -1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -3.8700 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -4.9020 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -5.4620 1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -6.5140 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -7.0960 2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -5.4200 -1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -5.9190 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -7.1340 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -7.8570 -3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -7.3650 -2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -6.1490 -1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 -5.5970 -1.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -6.2870 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -7.8080 -3.9760 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -1.9750 2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 2.1230 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 2.1150 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 2.3920 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 0.5450 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -0.1590 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -4.4860 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -5.7230 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -5.9100 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -4.6500 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -6.0610 3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -7.3150 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 -7.6050 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -6.3360 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -5.3600 -2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -8.8020 -3.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -7.9570 -2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 -6.3710 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 -7.2700 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 -5.7000 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -2.3440 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -2.7590 3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -1.1490 3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -8.1100 3.9460 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0490 -8.5370 4.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -8.8690 3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -7.6970 4.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 25 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 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 M CHG 1 48 1 M END