ANALYTICONDISCOVERY-ZINC05439001 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 2.0480 0.9810 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -0.3400 -0.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -1.0250 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -0.6500 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -1.4210 -3.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -2.5720 -3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -2.9580 -2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -2.1960 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -2.6280 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -3.7680 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -4.0500 2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -3.2830 2.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -2.1940 2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -1.8440 0.9430 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -1.3510 2.8960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -1.5620 4.2810 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6940 -2.5510 4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -1.3760 5.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -0.9430 6.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -0.4280 6.2670 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9710 0.6000 6.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -0.4860 4.7790 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0110 0.4830 4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -0.8470 4.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1520 -1.0700 5.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -1.3070 6.8650 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7040 -2.3620 6.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -0.9710 8.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2900 -1.6350 8.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9800 -2.5380 8.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3990 -1.1170 10.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5090 -1.7780 11.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6180 -1.2540 12.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7450 -0.4110 12.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 0.9680 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 1.5970 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 1.4330 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 0.2300 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -1.1200 -4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -3.1690 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -3.8560 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -4.3980 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -4.9230 2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -0.5760 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -2.3000 5.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -0.6040 4.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7330 -0.1770 6.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 -1.9190 5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 -0.2400 8.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 -1.2810 10.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 -0.0330 10.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4740 -1.6200 10.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3420 -2.8610 11.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5780 -1.7370 13.3090 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 33 34 2 0 0 0 0 33 54 1 0 0 0 0 M CHG 1 54 -1 M END