PUBCHEM-ZINC01084545 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.0840 1.9010 -0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 0.4860 -0.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -0.2630 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -1.6460 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -2.3740 -2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -1.7240 -3.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -0.4050 -3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 0.3170 -2.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 0.2220 -4.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 1.6470 -4.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -3.7550 -2.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -4.6090 -3.6500 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -5.9770 -3.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -4.1230 -4.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -4.1560 -3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 -4.8680 -2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 -4.5150 -2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 -3.4450 -3.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 -2.7330 -4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 -3.0940 -4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8470 -3.0850 -3.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7900 -4.0320 -3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4780 -5.2040 -3.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2320 -3.6340 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0320 -4.8070 -2.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3670 -4.6230 -2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8890 -3.3260 -2.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2200 -3.1100 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0880 -4.2030 -2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4680 -4.0160 -2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2790 -5.0970 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7610 -6.3910 -1.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4290 -6.6110 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5610 -5.5190 -2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1800 -5.7080 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4520 -7.4530 -2.5400 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 2.2690 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 2.1350 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 2.3790 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -2.1450 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 1.9360 -4.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 2.0700 -3.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 2.0210 -5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -4.2220 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 -5.7000 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 -5.0700 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 -1.9000 -4.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -2.5430 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1050 -2.1540 -3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5720 -3.0850 -3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3260 -3.0020 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2260 -2.4840 -2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6100 -2.1030 -2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8840 -3.0190 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3390 -4.9500 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4260 -7.2310 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0420 -7.6190 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 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 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 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 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 35 2 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 M END