PUBCHEM-ZINC06778391 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -2.5710 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -2.7880 -1.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7860 -1.8400 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 -3.9660 -1.1160 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.6190 -3.3280 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -3.4000 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -2.7840 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -2.4250 2.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -3.3440 -2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -4.2100 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -4.7220 -2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -4.3640 -4.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -3.4960 -4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -2.9910 -3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -1.8120 -4.2020 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -4.8640 -4.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -4.4530 -6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -5.5740 -2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -5.8970 -0.8190 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9210 -2.2940 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 -3.9390 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0650 -2.8790 2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -4.4450 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -4.4860 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -3.2160 -5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -4.9230 -6.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -4.7520 -6.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -3.3690 -6.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -6.3690 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -6.5830 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.9860 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 M END