MDPI-ZINC03846673 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 0.6800 1.6280 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 0.2060 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.2980 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 0.5410 2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 1.6930 2.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 0.0660 3.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 0.9700 4.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -0.5740 -1.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -0.1630 -2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -0.8690 -3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -0.4600 -4.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 0.6500 -3.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 1.3560 -2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 0.9490 -1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 1.7660 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 1.8390 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 2.3080 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -1.3430 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 1.8280 4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 0.4630 5.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 1.3090 4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -1.4120 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -1.7360 -3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 -1.0090 -4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 0.9680 -4.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 2.2240 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 1.4970 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 18 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 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 M END