IBS-ZINC04906400 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 0.3940 1.8040 2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 1.0040 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 0.7560 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 1.3080 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 2.1090 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 2.3550 1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 2.7100 0.3110 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0870 2.0390 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 2.9730 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 4.3040 1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 4.9430 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 6.1330 0.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 4.0140 -0.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 4.2590 -1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 4.4120 -1.3160 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7780 3.5630 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 4.5370 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 5.5590 -2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 5.9300 -0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 5.6470 -0.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 4.9490 2.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 1.9750 2.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 2.3330 3.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 0.5480 2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 -0.4650 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 -1.7100 2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -1.7210 1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 -0.1360 0.7900 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 1.0420 -1.5830 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5940 0.3100 -2.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 1.5550 -1.8740 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0550 2.0010 3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 0.5720 1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 0.1310 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 2.9800 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 5.1730 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 3.4200 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 4.9130 -3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 3.5760 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 6.4400 -2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 5.1030 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 6.9870 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 5.3150 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 5.9050 2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 -0.3020 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -2.6140 3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -2.6130 0.8670 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 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 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 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 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END