IBS-ZINC05451993 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.1560 1.6800 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 0.1630 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -1.8000 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -2.2870 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -2.0300 0.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -0.6450 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -0.1490 1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -2.9850 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -2.7540 2.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -4.2810 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1170 -4.6410 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0980 -6.0740 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5420 -7.0120 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 -8.3770 -0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7870 -8.8220 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 -7.9090 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 -6.5460 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -5.4480 1.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 -5.4850 2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9620 -9.6410 -2.2460 Br 0 0 0 0 0 0 0 0 0 0 0 0 -5.7310 -3.7380 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 2.0250 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 2.1100 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 2.0810 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -0.1950 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -0.2800 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -2.3750 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -1.8670 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -1.7560 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -3.3510 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -0.0380 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -0.5280 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 0.9170 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -0.7120 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0070 -6.6740 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 -9.8870 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -8.2520 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -3.6500 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6980 -4.1310 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9070 -2.7370 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -0.3380 0.0860 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8140 0.2090 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 11 21 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 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 41 1 M END