ANALYTICONDISCOVERY-ZINC04260683 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.6730 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 0.1830 0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -0.6560 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -2.0470 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -2.6410 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -1.7830 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -0.3910 -0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -4.0830 0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -4.6180 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -3.9350 -2.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -6.1410 -1.3420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1610 -6.3390 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -6.8560 -0.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2830 -7.8760 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -6.9240 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -7.2140 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -6.6920 -2.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -6.7170 -3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -6.2970 -3.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -7.3260 -4.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -7.4510 -6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -8.3170 -6.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -6.0520 -6.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -8.1570 -7.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -8.5600 -8.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -8.0300 -9.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -6.2050 1.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -4.8670 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -4.4680 2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 1.9620 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 2.1550 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 2.0500 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -0.2360 2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -2.6510 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -2.1750 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 0.2380 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -5.9660 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -7.6930 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -6.7330 -2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -8.2910 -2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -6.7270 -5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -8.3290 -4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -7.8590 -5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -8.4750 -7.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -9.3040 -5.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -5.4460 -6.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -6.0970 -7.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -5.5070 -6.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -7.5290 -7.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -9.0860 -6.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -6.7440 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -9.3870 -9.1800 O 0 5 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 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 28 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 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 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 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 M CHG 1 52 -1 M END