MDPI-ZINC03851916 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 -0.0710 0.7380 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -0.6880 -0.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7900 -1.1960 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -1.4150 0.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -2.6730 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -3.2020 0.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -3.4210 2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -4.8150 2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -5.5750 3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -6.9680 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -7.6960 4.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -7.6760 5.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -7.0620 6.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -8.5280 6.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -8.8790 7.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -9.7250 8.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 -10.2200 7.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 -9.8780 5.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -9.0340 5.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -8.4760 4.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -8.6850 3.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -0.6290 -1.8030 P 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 0.2210 -1.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -2.1180 -2.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -2.1770 -3.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -2.1320 -3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -2.1920 -4.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -2.2960 -5.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -2.3400 -5.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -2.2870 -4.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.0130 -2.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 1.3200 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 1.7750 -3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 3.1310 -4.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 4.0340 -3.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 3.5830 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 2.2280 -2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 1.2810 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 1.2440 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 0.7030 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -0.9920 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -3.5140 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -2.8760 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -4.7220 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -5.3590 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -5.6680 2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -5.0300 4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -6.8750 3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -7.5130 2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -8.4940 8.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 -9.9980 9.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 -10.8780 7.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3140 -10.2680 4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0650 -2.0500 -2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 -2.1560 -4.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 -2.3420 -6.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -2.4210 -6.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -2.3270 -4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 1.0700 -4.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 3.4860 -4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 5.0930 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 4.2900 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 1.8760 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 4 5 1 0 0 0 0 4 41 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 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 22 31 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 59 1 0 0 0 0 34 35 1 0 0 0 0 34 60 1 0 0 0 0 35 36 2 0 0 0 0 35 61 1 0 0 0 0 36 37 1 0 0 0 0 36 62 1 0 0 0 0 37 63 1 0 0 0 0 M END