PUBCHEM-ZINC03738084 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.5490 1.3650 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.0450 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -0.4210 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -1.7550 -0.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -2.2980 -2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -3.6150 -2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -4.2970 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -3.6710 -4.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -2.3430 -4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -1.6640 -3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -4.4150 -5.5940 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2370 -5.4690 -5.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -4.3790 -6.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -4.1850 -8.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -4.2510 -8.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -4.1250 -10.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.2550 -10.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -4.5030 -10.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -4.6310 -8.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -4.5000 -8.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -4.5800 -6.8690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -4.7570 -6.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -4.0880 -12.7690 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.1150 -3.9480 -8.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -4.3990 -7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 2.0990 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 1.4700 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 1.6070 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -0.1400 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -0.7600 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -0.3680 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 0.2700 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -4.1150 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -5.3220 -3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -1.8190 -5.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -0.6420 -3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -3.9320 -11.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -4.6020 -10.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -4.8260 -8.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 -4.4830 -9.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -2.8770 -8.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0500 -5.4900 -7.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 -4.0020 -7.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 -3.8860 -5.9380 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4020 -2.8610 -5.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 -4.1120 -5.1670 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 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 44 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 24 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 37 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 M CHG 1 44 1 M END