OTAVA-ZINC05371238 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0810 1.9010 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 0.3730 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -0.2060 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -1.7330 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -2.3120 2.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4320 -1.8740 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -3.8070 2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -4.5380 3.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -2.0020 3.5810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -1.2880 4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -0.8640 4.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -1.0460 5.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.3540 6.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -0.0780 7.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 0.2180 9.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 0.4760 10.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 0.4420 9.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 0.1480 8.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -0.1050 7.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 0.6960 10.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -1.8680 5.3350 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -2.4330 3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -3.3580 2.6280 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 2.2700 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 2.3130 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 2.2060 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 0.0040 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 0.0680 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 0.1640 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 0.1000 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -2.1020 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -2.0390 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -0.0050 6.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 0.2440 9.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 0.7040 11.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 0.1220 8.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -0.3280 6.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 1.6290 10.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -4.3260 1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -5.2900 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 39 40 1 0 0 0 0 M END