PUBCHEM-ZINC03870762 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 69 0 0 1 0 0 0 0 0999 V2000 -1.2020 2.4750 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 1.1040 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 0.2030 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 0.6570 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 2.0260 0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 2.9240 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 4.6630 0.8570 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 4.9100 0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 5.3660 0.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 4.8890 2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 6.3400 2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 6.5110 4.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 6.3830 4.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 6.0930 4.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 6.6250 6.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 6.9060 6.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 6.8170 5.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 7.0000 5.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 7.2010 7.7860 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3280 6.6020 8.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 6.8680 8.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 6.6040 8.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 6.5950 6.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 8.6910 7.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 9.5080 8.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 9.0110 7.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 10.3190 7.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 10.4020 8.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 11.7470 8.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 11.9330 9.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 11.7730 10.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 10.4140 10.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 10.2180 9.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 11.9730 11.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0460 12.9720 12.6160 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2510 13.5980 12.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 13.1560 13.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -1.6540 0.4970 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 3.1720 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 0.7510 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -0.0430 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 2.3760 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 4.5670 3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 4.2360 2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 6.6720 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 6.9810 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 6.8800 9.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 6.3990 9.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 5.6930 6.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 7.4570 6.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 8.3040 6.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 11.0790 7.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 10.5040 6.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 9.5960 8.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 12.5720 8.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 11.8160 7.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 12.9260 9.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 11.2050 9.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 12.5470 10.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 10.3300 11.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 9.6020 10.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 9.2120 9.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 10.9290 9.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 11.1560 11.8630 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 10.3890 11.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9630 11.2650 12.5790 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 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 35 2 0 0 0 0 34 64 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 64 65 1 0 0 0 0 64 66 1 0 0 0 0 M CHG 1 35 1 M END