IBS-ZINC04044184 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 47 0 0 1 0 0 0 0 0999 V2000 -0.2080 1.1600 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -0.2190 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -0.8360 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -0.0700 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 1.3180 0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 1.9220 0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 2.1930 0.6140 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2680 2.8470 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 1.4190 0.5110 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4860 2.0380 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 1.1300 2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 2.3860 2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 2.9850 1.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 0.1360 -0.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1880 0.3640 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -0.6490 0.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -1.8320 0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 -2.8540 1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 -1.6000 1.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6160 -0.9260 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 -0.7940 -0.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5920 -1.7560 -1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 -2.4970 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4290 -2.0280 -0.1990 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4930 -2.2590 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5450 -2.6030 0.9460 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1000 -2.6400 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0230 -3.9670 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -4.0700 -0.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0700 -0.5830 -0.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 1.6450 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.8100 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -1.9120 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 2.9980 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 0.2320 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 1.0430 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9620 2.1020 3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 3.0890 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -1.8200 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 -3.2660 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 -5.0680 1.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2390 -5.9210 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 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 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 41 1 0 0 0 0 41 42 1 0 0 0 0 M END