MDPI-ZINC03847999 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7090 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0980 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.7920 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.1050 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.7220 3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.0220 2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6980 -1.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -0.7540 -1.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -1.3550 -3.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.6350 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -3.8720 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -2.6500 4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.1890 4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 1.0580 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -1.1380 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -0.2640 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 9 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 15 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 M END