IBS-ZINC05443440 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 0 0 0 0 0 0999 V2000 -0.1480 0.9470 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 1.0480 2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 1.5600 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 3.5170 2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 2.9360 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 3.6000 4.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 5.0720 4.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 6.0090 4.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 7.3940 4.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 7.8840 5.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 6.9610 5.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 5.5870 5.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 4.8560 6.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 5.7810 6.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 5.5330 7.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 4.2280 8.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 3.0670 8.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 1.8540 8.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 1.8330 8.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 2.9580 8.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 4.1640 8.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1890 2.7340 8.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 1.3450 9.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 0.7600 9.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 7.1560 6.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 8.2100 7.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 5.5440 3.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -0.1480 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 1.3210 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 1.2240 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 1.4040 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -0.0470 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 1.1500 3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.3040 4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 4.6090 2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 3.1790 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 3.2300 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 3.3900 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 3.0550 5.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 3.3050 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 8.1010 4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 8.9460 5.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 6.3850 8.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 3.0980 8.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 0.9660 8.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 5.0340 8.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8360 0.7820 8.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 1.2600 10.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 6.2860 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 1.4690 1.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 3.0750 3.5270 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1110 3.4610 3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 50 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 51 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 50 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 51 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 25 26 2 0 0 0 0 27 49 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END