IBS-ZINC04044864 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 -0.7760 -0.2180 1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -1.6800 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -2.0090 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -1.0440 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -1.4070 0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -2.7520 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -3.7430 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -3.3440 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -4.3650 1.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -4.1030 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -5.0280 2.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -2.6750 2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -2.4680 2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -2.4180 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 -2.1410 1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 -1.9490 3.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0290 -5.2040 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 -3.2010 0.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 -2.2400 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2230 -2.9940 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3830 -2.9870 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6630 -2.1810 2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5420 -3.8360 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 0.2760 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -0.0390 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 0.2860 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 0.0180 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 -0.6070 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -3.2650 3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -1.5560 3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -1.6330 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -3.3700 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 -5.5560 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -5.8120 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 -5.3850 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 -1.5500 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 -1.6810 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -3.6240 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8770 -2.8490 2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5360 -1.5390 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8380 -1.5310 2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3080 -4.4140 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4080 -3.2050 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8240 -4.5450 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9730 -2.1310 0.8600 O 0 5 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 12 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 M CHG 1 45 -1 M END