MDPI-ZINC03844949 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 32 0 0 0 0 0 0 0 0999 V2000 -3.7960 1.2480 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -0.1950 -2.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 -0.7800 -1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -0.1020 -0.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -2.2320 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -2.8170 -0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -4.2510 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -5.0220 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -6.3660 0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -6.9610 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -6.2040 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -4.8430 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 -6.8400 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 -8.1180 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6300 -8.8020 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5920 -8.2200 0.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7510 -10.0790 -0.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0590 -10.6950 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -9.0240 -0.9470 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 -3.2870 -2.2780 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.4820 1.5890 -3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 1.7140 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 1.5250 -2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -2.2340 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -4.5640 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -6.9560 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -8.0140 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 -4.2520 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 -6.2850 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7880 -10.1270 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0180 -11.7190 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3530 -10.7010 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 M END