PUBCHEM-ZINC06025229 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0290 1.5250 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -0.4660 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8090 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -2.6680 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -4.0350 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -4.5590 -1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -3.7200 -2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -2.3340 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -1.4330 -3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -1.9420 -4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -1.0460 -5.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 0.1600 -5.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -1.5540 -6.6770 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 -0.7020 -7.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 0.5600 -7.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 1.3990 -8.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 0.9840 -9.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -0.2720 -10.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 -1.1180 -9.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 2.0580 -10.9930 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 1.6360 -12.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 3.3790 -10.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 1.7600 -11.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6450 0.5240 -11.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8790 0.1880 -11.9060 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0950 -1.0350 -12.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9930 -1.7650 -12.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 -0.7810 -12.0700 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -6.4330 -1.8550 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 1.9090 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.8790 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.8760 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.3590 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.3890 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -2.2690 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -4.7000 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -4.1320 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -0.3630 -3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 -3.0120 -4.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 -2.5110 -6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7260 0.8850 -6.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4970 2.3810 -8.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 -0.5930 -11.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 -2.1000 -9.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8820 2.4490 -11.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0850 -1.4130 -12.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9570 -2.7830 -12.8900 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 1 0 0 0 0 2 34 1 0 0 0 0 2 35 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 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 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 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 M END