MDPI-ZINC03845466 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.0020 1.5200 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.0080 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -0.6410 1.1980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3370 -0.4680 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -2.1300 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -2.0600 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -0.5180 -1.1190 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3860 0.0190 -0.5440 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5470 1.0510 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -0.0620 0.9900 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2930 0.9300 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -1.0010 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -1.1120 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -1.8900 3.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -0.8040 -0.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.1420 -2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -0.5990 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 1.9060 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 1.9160 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.8260 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -2.6140 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -2.6630 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -2.5100 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -2.5590 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 -1.9880 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -0.6040 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -0.1150 3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -1.5940 3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 -2.0020 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 -0.4670 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 0.9440 -2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -0.5500 -3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -0.5510 -2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -0.2290 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -1.6860 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -0.3020 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 M END