MDPI-ZINC03844768 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6810 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0430 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7430 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.1350 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.7930 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -4.0170 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -4.7160 -3.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -6.0780 -3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -6.7560 -2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -6.1330 -1.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -8.2620 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.6250 -2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -1.9670 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6270 -1.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1210 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.5730 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -4.7020 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -4.1860 -4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -6.6380 -4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -8.6130 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -8.6370 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -8.6270 -3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.0580 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 16 2 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 M END