MDPI-ZINC03845901 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 -0.0330 1.4720 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.0550 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -0.6130 1.2080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5440 0.1400 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -1.8120 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -1.3020 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.4930 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1790 0.7350 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -1.3580 -2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -2.5280 -2.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -1.0810 2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -1.6350 3.8810 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -0.6330 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 1.8740 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 1.8570 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.7720 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -2.0270 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -2.6920 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -0.6600 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -2.1400 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 1.3400 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 0.4150 -2.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 1.3260 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -0.2640 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -1.9240 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -0.2080 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -1.7160 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -0.3870 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.8270 -2.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -1.4210 -3.1840 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 7 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 29 30 1 0 0 0 0 M END