MDPI-ZINC01719369 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.0980 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 -0.5520 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9380 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -2.6760 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -2.0260 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7520 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -4.1820 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 -4.0620 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 -2.5990 0.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4160 -2.5480 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 -1.8800 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6160 -1.8050 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4600 -1.1470 -3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6240 -0.5610 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9400 -0.6360 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0930 -1.3020 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0820 -0.0610 -0.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4550 0.0880 -3.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 1.1770 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 0.0230 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -2.9700 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -4.5330 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -4.5570 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8230 -4.5790 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -4.1160 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7080 -2.2620 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 -1.0900 -4.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3380 -1.3660 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8500 -0.6480 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1340 -0.4780 -3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -4.6880 0.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -5.6940 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 11 37 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 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 37 38 1 0 0 0 0 M END