MDPI-ZINC01724162 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6880 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 0.0390 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 -0.6580 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3420 -0.0170 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4670 -0.7860 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4100 -2.1100 -0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2760 -2.7750 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 -2.0790 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -2.7310 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 -4.0840 -0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -2.0230 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 -4.4810 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9840 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 1.1180 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 1.0610 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4330 -0.3020 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2810 -3.8550 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 19 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 17 2 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 M END