IBS-ZINC02133489 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 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 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7890 -2.4840 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -2.5900 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -3.2160 -0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -2.3710 1.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -2.8880 1.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3810 -2.8460 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -4.3380 1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6450 -2.0510 2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 -1.1180 2.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.4260 -1.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -2.0010 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -2.2860 -3.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -3.0410 -3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -3.3470 -5.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -4.1160 -5.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -4.5940 -4.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -4.3060 -3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -3.5280 -2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -3.1830 -1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -3.5660 -0.5060 O 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 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -1.8700 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 -4.9440 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 -4.3810 2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8490 -4.7240 1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -1.3950 -2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -2.9820 -6.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -4.3520 -6.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -5.1960 -4.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 -4.6800 -2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9240 -2.3420 2.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3720 -1.7770 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 44 45 1 0 0 0 0 M END