PUBCHEM-ZINC05048670 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0020 1.0870 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 1.0940 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 3.0260 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 3.4560 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 4.9160 0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 5.5250 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 4.8630 -1.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 6.9990 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 7.7740 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 9.1700 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 9.7790 -0.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 9.1130 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 7.6990 -1.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 7.0050 -2.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 7.6970 -3.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 9.0860 -3.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 9.7920 -2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 9.9860 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 11.3740 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 12.1290 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 11.5100 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 10.1320 3.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 9.3670 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 12.5510 4.5180 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0030 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 1.4640 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 1.5280 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 0.0070 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.4010 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 3.4720 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 3.3590 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 3.0100 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 5.4450 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 7.3080 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 5.9270 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2660 7.1600 -4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 9.6120 -4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 10.8690 -2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 11.8580 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 13.2050 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 9.6540 3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 8.2920 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 1.5620 1.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 45 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 M END