IFLAB-ZINC05258465 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 -1.0150 2.6210 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 1.1580 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 0.2750 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -1.1880 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 -2.0710 0.9840 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5520 -1.7180 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -2.0030 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4580 -2.7710 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -3.5170 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 -5.7400 1.6030 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5680 -5.7720 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 -6.4150 2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -5.7680 3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4040 -4.8560 3.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 -6.2020 4.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 -5.6790 5.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5580 -5.0450 6.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9090 -4.5300 7.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2100 -4.6450 7.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1640 -5.2760 6.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8220 -5.7870 5.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1290 -6.6420 4.6460 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -6.4660 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -5.8780 -0.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 3.2500 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 2.7380 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 2.9180 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 0.8610 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 1.0410 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 0.5720 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 0.3920 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -1.4850 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -1.3050 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 -0.9620 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -2.4490 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 -2.6200 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -3.8340 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 -2.4060 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -3.9000 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -3.5520 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3850 -6.3050 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -7.4740 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7200 -6.8760 3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5420 -4.9560 5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1660 -4.0370 7.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4810 -4.2420 8.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1790 -5.3650 7.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 -4.3420 1.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 -3.9690 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -7.7650 0.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -8.1870 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 10 48 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 48 49 1 0 0 0 0 50 51 1 0 0 0 0 M END