MDPI-ZINC03844307 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -1.7220 1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -2.1410 2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -1.3360 3.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -0.1830 2.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 0.2440 1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -0.0130 -1.2670 F 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -1.8960 -1.2640 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -0.0340 -2.3900 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -2.3290 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -3.0840 3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -1.6550 4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 1.1920 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -1.4640 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 13 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 17 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 13 21 1 0 0 0 0 M END