MDPI-ZINC03843335 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 0.0190 1.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6880 -0.3330 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 1.5480 1.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6460 1.9000 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 2.0700 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 1.2980 1.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -0.4800 2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 0.3060 3.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 -1.8000 2.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 -2.2080 3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8240 -3.7360 3.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 -4.2250 2.8220 O 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7040 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 3.1450 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 -1.8050 3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -1.8300 4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -4.0440 4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -4.1430 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 -5.1880 2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 3.3930 1.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 3.6800 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 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 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 30 31 1 0 0 0 0 M END