MDPI-ZINC03847903 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 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 0.7470 -0.5000 1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 0.0120 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -0.3750 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -0.9480 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -0.0250 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -0.5290 -1.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7120 -1.6270 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -0.0930 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -0.5140 -2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -1.1730 -3.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -0.0760 -1.1500 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2820 1.0230 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -0.5380 0.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9200 -0.1930 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -2.0720 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8240 -2.5830 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 -2.0730 -0.7670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6710 -0.5820 -1.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2470 0.0150 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -0.4460 -2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 -1.8730 -3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -2.7820 -2.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -3.8300 -2.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2170 -2.3270 -0.2320 C 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 1.8780 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -0.1390 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.5900 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 1.0890 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -0.4610 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 1.0490 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -0.5200 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 0.9820 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -0.5920 -3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -2.4180 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -2.4450 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -3.6750 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -2.2660 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 -0.0070 -2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 0.1910 -3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 -2.1760 -3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 -1.9200 -4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3550 -1.7860 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 -1.9810 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3540 -3.3940 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 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 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END