CHEMDIV-ZINC04791736 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 0 0 0 0 0 0999 V2000 0.2360 -1.9430 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -2.1010 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -0.7060 2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -0.4200 3.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -0.3610 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 1.1590 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 1.5560 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 2.9920 0.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 3.5460 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3670 2.8790 0.5550 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 5.0630 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 5.6550 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 7.1840 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0510 7.7310 0.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5660 8.0400 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 7.8840 -1.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9340 8.5800 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5330 8.9240 -1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8320 9.4290 -1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5320 9.5910 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9270 9.2440 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6260 8.7390 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0180 8.3910 1.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5170 8.5000 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7470 7.8930 1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2920 7.6120 2.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6550 9.8980 -3.5930 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -1.5760 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -2.9100 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -1.2480 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -2.4890 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -2.7790 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 0.0950 3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -1.6610 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -1.2050 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -0.3540 4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 0.5320 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -0.7680 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 -0.8360 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 1.5890 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 1.5950 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 1.1450 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 1.1660 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 3.6040 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 5.4020 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 5.3940 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3530 5.2700 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 5.3200 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1010 7.5710 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2200 7.5200 1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9890 8.7950 -2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5450 9.9850 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4800 9.3720 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -0.7500 1.4040 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2760 -0.0510 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 54 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 2 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END