PUBCHEM-ZINC03752574 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 0.1950 1.4020 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 0.0110 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -0.7020 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -0.0370 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 1.3550 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 2.0820 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 3.5360 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 4.3940 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 5.7370 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 7.0280 0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 8.1800 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 8.0230 -0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 6.7620 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 5.6460 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 4.3120 -0.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 3.9480 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 9.5650 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 9.6430 1.6910 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2470 4.0060 1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 3.1920 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 3.6810 0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -2.5880 -0.2940 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 1.9590 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -0.5030 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -0.5840 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 1.8730 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 7.1370 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 8.9050 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 6.6630 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 4.8970 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 3.4400 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 10.5530 0.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.1170 1.6960 O 0 5 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 32 2 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 M CHG 1 18 -1 M CHG 1 33 -1 M END