PUBCHEM-ZINC03725770 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8110 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.6690 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -4.0370 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5520 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -3.7020 -2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -2.3300 -2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -1.4920 -3.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -2.0950 -4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -1.0020 -5.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -6.0440 -1.8430 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2990 -6.2720 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -6.5630 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -6.8300 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -7.3050 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -7.5140 0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 -7.2470 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -6.7670 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7590 -8.1640 1.6000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -8.1450 -1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -8.7810 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -6.7740 -1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -6.1380 -2.1620 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -2.2690 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -4.7050 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -4.1070 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -2.7050 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -2.7230 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -1.4620 -6.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -0.3920 -5.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 -0.3750 -4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -6.6670 -2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4710 -7.5130 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -7.4100 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -6.5540 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -8.5280 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -8.3900 -2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -9.8600 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -8.5590 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -6.5290 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -6.3900 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -6.3600 -3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -5.0580 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -6.6860 -1.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -8.2330 -1.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -8.4890 -2.7740 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 51 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 51 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 52 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 52 53 1 0 0 0 0 M END