IBS-ZINC06645407 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.2570 1.4940 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5350 -0.1790 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.5010 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -0.9720 2.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -0.4230 1.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -1.0020 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 0.0770 2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 0.6600 1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 1.3080 0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 0.2380 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 1.6970 2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 1.9450 3.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -0.7210 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -0.8420 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -0.3570 -2.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -1.5010 -1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 -1.5920 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 -2.3180 -3.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 -2.3700 -2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 -0.1850 -2.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 2.0260 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 1.8560 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 1.6680 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -1.3500 2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -1.8370 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 0.8690 3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -0.3640 3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3140 -0.1380 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 2.0890 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 1.7430 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -0.4980 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 0.7080 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -1.1080 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 -3.3200 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -2.3860 -4.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -1.7630 -3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7580 -1.8530 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 -2.4380 -3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 -3.3720 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 0.3700 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 -0.2530 -3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 0.3320 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5300 2.3460 1.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1310 3.0030 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 44 45 1 0 0 0 0 M END