MDPI-ZINC03843757 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0020 1.4880 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.0360 0.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7060 -0.5640 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -0.1430 1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -0.6390 0.1750 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9310 -0.2820 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 -0.1060 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -0.5690 -1.0850 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7420 -1.6700 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.1700 -2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -0.7050 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -0.1200 -1.1900 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0020 0.9820 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -0.5870 0.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3030 -1.6770 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -0.2100 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -1.0220 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 -1.4470 -0.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5780 -0.3920 -1.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0910 0.5610 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2520 -0.9420 -2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6060 -1.4890 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4870 -1.5310 -0.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8720 -2.4640 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 -0.4070 0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 -2.8340 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -2.0680 0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 1.8570 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 1.8640 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8320 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.1600 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -1.6520 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 0.9390 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -0.5840 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 0.9770 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 -0.5100 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 0.9120 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.6010 -3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -0.3860 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -1.7900 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -0.4080 2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 0.8550 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -1.9090 1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -0.4120 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4260 -0.1350 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -1.7300 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 -0.8230 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 -2.4900 -2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 -0.4030 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 -3.5360 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 -3.1700 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -2.7800 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -2.4730 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 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 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 M END