MDPI-ZINC03847660 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 1 0 0 0 0 0999 V2000 -0.2410 1.4120 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.1000 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -0.4420 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 0.0460 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -0.4850 3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -1.4910 3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -1.9770 1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -1.4480 0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -1.7570 -0.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.7500 -1.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4350 0.0090 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -1.3030 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -2.3910 -2.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.7560 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 1.9090 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 1.6360 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 1.8720 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 0.8110 2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -0.1210 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 -1.8940 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 -2.7470 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -2.5230 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -0.5190 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -1.8480 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -0.4060 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -0.5810 -2.8270 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 14 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 18 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 M CHG 1 26 -1 M END