IBS-ZINC02399186 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.5620 0.3850 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -1.0290 -0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -1.6100 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -2.9290 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -3.8020 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -4.9670 0.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -3.1730 -1.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -1.8120 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -1.3470 -2.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -3.9660 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -3.1390 2.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -1.9170 3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -0.9790 2.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -1.6810 4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -1.7640 6.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 -1.8220 7.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -0.6760 5.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -0.6550 4.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -0.6520 7.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -4.4170 3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -4.7190 3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -4.4150 4.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -5.3370 2.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -5.6010 2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -5.5280 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 0.9670 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 0.7080 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 0.5740 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -3.9140 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -3.5380 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -5.0140 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -2.4120 5.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -0.6960 4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -0.8680 7.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -2.6360 7.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 -2.7510 7.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -1.7260 8.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 0.2150 5.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 -1.5760 5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -0.7120 3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 0.3090 5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 -0.5920 8.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -1.5670 7.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4160 0.2330 7.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -4.4050 4.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -5.1970 2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -1.7710 5.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 -0.6660 7.0150 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0530 0.2030 7.2900 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 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 47 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 48 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 47 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END