PUBCHEM-ZINC06524459 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3960 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 1.2330 -0.6620 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 0.0230 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.3420 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.0680 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 3.9590 0.0110 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -0.7730 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -0.1900 0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -2.1200 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -2.5860 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -2.8820 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2350 -2.3490 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -4.2610 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -4.1020 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -3.0000 -2.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -3.0450 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -2.5710 2.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4090 -3.8990 1.7520 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 1.9370 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -1.7410 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 1.8630 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -4.7590 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -4.8590 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -3.7950 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -5.1860 -2.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -5.0340 -3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 25 1 0 0 0 0 26 27 1 0 0 0 0 M END