MDPI-ZINC02385217 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 0.6840 1.2450 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.0480 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 -0.9690 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -1.8120 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -1.4760 2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -2.2500 3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -3.3650 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -3.7130 2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -2.9330 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -3.2950 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -2.5610 -1.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 1.6500 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 1.9040 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -0.4530 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -1.6160 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -0.3780 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -0.6070 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -1.9820 4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -3.9650 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -4.5840 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -4.4400 -0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -4.6350 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 21 22 1 0 0 0 0 M END