MDPI-ZINC03847381 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 1.0870 2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 1.5260 3.6040 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8920 1.1910 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.2220 4.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 0.0980 5.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 0.1490 6.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 1.2760 7.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 2.4130 7.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 2.3760 5.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 3.3770 4.9460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 3.0810 3.6160 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1880 3.4270 3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 3.5340 2.4180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6860 4.6230 2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 3.0080 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 2.9890 2.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 1.5400 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 0.0010 2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -0.7880 5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -0.7150 7.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 1.2730 8.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 3.2920 7.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 4.1080 5.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 3.2560 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 3.4960 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 3.2440 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 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 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 16 31 1 0 0 0 0 17 30 1 0 0 0 0 M END