CHEMBRIDGE-ZINC04008559 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0410 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 -2.6590 0.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -2.7010 -1.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -4.0830 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -4.8070 -1.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -6.2480 -1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -6.6920 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -5.1140 0.2360 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -0.0610 1.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 1.1530 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 1.8540 0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 1.6390 2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 3.0350 2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 3.5290 3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 2.5670 3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 1.1710 4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 0.6770 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 1.2290 5.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 2.1910 4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 3.5870 4.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 1.6980 3.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -2.2060 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -6.6530 -2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -6.6370 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -7.2760 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -7.2590 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -0.6220 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 3.7200 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6890 2.9940 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 4.5240 3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3450 2.9190 4.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5430 2.5260 2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0740 0.4860 4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 0.6360 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -0.3170 2.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 1.5810 6.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 0.2350 5.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 2.2330 5.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 4.2720 4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 3.9390 5.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 0.7030 3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 2.3820 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 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 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 M END