MDPI-ZINC03120460 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 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 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 0.0370 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0960 -0.6580 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 0.0060 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4840 -0.7210 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4520 -2.1140 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2700 -2.7910 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -2.0770 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 -2.7280 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 -4.0820 -0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 -2.0230 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 -4.4790 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 -0.0180 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 4.8550 1.1170 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3690 1.0850 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4350 -0.2100 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3800 -2.6660 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2620 -3.8710 -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 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 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