MDPI-ZINC03846370 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -0.1510 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 0.4800 2.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -1.2710 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -1.7190 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -1.3840 -3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -0.5960 -3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -0.1580 -2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -1.8600 -4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 -2.5460 -4.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -1.6190 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -1.5290 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -2.3280 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -0.3330 -4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 0.4480 -2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -0.5120 1.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -1.5350 -5.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -1.8700 -6.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -0.2440 2.3870 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 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 M END