PUBCHEM-ZINC01067946 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8480 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -2.6800 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -4.0510 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -4.5960 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -3.7690 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -2.3970 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -1.3450 0.0480 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -0.3750 -0.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -2.1990 0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -0.5250 1.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 0.4240 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 1.3050 2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 2.2810 3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 3.5100 2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 4.1020 3.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 4.9920 2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 3.2470 4.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 2.0710 4.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 1.0170 4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 1.1370 5.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 2.3000 5.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 3.3450 4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -0.2870 6.8530 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 4.1430 1.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -6.0920 -0.0130 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 0.5120 -0.3560 -0.8950 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 0.6050 -2.2550 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -4.6980 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -4.1970 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 -0.6720 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -0.1240 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 1.0500 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 1.8530 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6430 0.6790 3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 0.1120 5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 2.3820 6.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 4.2440 4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 4.6880 2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 4.8330 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 3.3670 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -6.4590 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -6.3450 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -6.5540 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END