MDPI-ZINC03845531 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 0.4080 1.4310 1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 0.1670 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -0.4430 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 0.2060 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 1.4880 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 2.0930 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 2.1850 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 3.5270 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 4.2540 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 5.1950 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 5.8690 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 5.6130 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 4.6750 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 4.0020 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 6.2980 -0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 4.2520 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9350 3.6550 -0.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -0.4080 -0.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 1.9000 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -0.3430 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.4280 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 3.0770 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 1.6360 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 5.3940 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 6.5980 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 4.4780 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 3.2780 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 6.9520 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 6.1200 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 -1.2920 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 0.0480 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 5.5800 -0.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6930 6.0130 -0.7960 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 16 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 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 15 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 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 32 33 1 0 0 0 0 M END