MDPI-ZINC03160287 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 27 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0150 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4250 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0970 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 1.8480 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 2.9960 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 0.7490 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -0.3700 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 -1.5070 -0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9700 0.7680 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -0.4180 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0790 -0.3560 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7040 0.8060 -0.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0470 1.9500 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 1.9740 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9020 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1770 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 -1.3720 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6530 -1.2710 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5970 2.8800 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1370 2.9150 -0.0520 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 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 M END