PUBCHEM-ZINC02341148 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -0.4940 0.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -0.5210 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.4010 -1.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -0.5630 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -2.0420 -1.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8550 -2.6210 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -2.2110 -1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -3.6360 -1.7750 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2560 -4.4530 -2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 -4.2080 -4.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -5.2300 -5.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 -6.5070 -4.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -6.7690 -3.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 -5.7450 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8390 -5.6840 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 -4.3580 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 -4.0000 0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 -4.9440 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3470 -6.2530 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2120 -6.6290 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -2.5040 -0.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -0.5820 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 0.0420 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -0.1380 -3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -0.9400 -4.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -1.5620 -4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -1.3810 -3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 -1.1850 -6.1220 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -0.2110 -2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 0.0160 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -1.7780 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 -1.7040 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -3.2180 -4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 -5.0350 -6.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 -7.3000 -5.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -7.7640 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 -2.9820 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2030 -4.6600 2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 -6.9840 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 -7.6500 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -2.0320 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 0.6670 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 0.3470 -3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -2.1870 -5.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -1.8630 -3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M END