IBS-ZINC04937825 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 3.3010 1.9030 3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 0.8790 2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 0.8430 2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 0.4060 2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -1.3090 1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -2.2650 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -3.6110 2.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 -4.2050 1.6350 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1830 -3.6030 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 -5.5540 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -5.7180 1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -4.4650 2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -4.2690 2.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -6.7940 1.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -6.6260 0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 -7.7720 1.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2610 -6.2870 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -6.8950 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4910 -6.6030 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 -5.7140 -2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 -5.1200 -2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -5.4070 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -4.2610 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 -3.8140 2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 -3.8900 2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3810 -4.4160 4.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1430 -4.8640 4.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -4.7890 3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7600 -4.5160 5.2810 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 1.4200 4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 2.4450 3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 2.6410 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 1.3410 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 0.1800 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 0.6610 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 1.9110 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 0.9790 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -0.6540 2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 0.5820 3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -1.2090 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -1.6790 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -1.9000 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -2.3380 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -6.5640 1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -7.5950 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4700 -7.0740 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9580 -5.4960 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7180 -4.4450 -3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9810 -4.9590 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -3.4130 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4770 -3.5470 2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 -5.2810 5.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -5.1570 4.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 0.0880 2.5050 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7290 -0.0320 3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 54 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 44 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 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END