MDPI-ZINC03846810 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 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 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0820 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0690 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.8140 -2.5200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6200 -3.7160 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -3.1900 -2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -4.4390 -2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -4.7840 -2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -3.8790 -3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -2.6290 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -2.2830 -3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7650 -4.3510 -4.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -1.9790 -3.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1290 -0.0210 O 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 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6250 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -5.1460 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -5.7600 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -1.9220 -4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -1.3060 -3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -1.1560 -3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -4.5350 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 M END