PUBCHEM-ZINC04529061 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 1 0 0 0 0 0999 V2000 -0.1930 1.6310 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 0.1110 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -0.4080 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.9370 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.4540 -2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -3.9630 -2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -4.6650 -3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -6.0610 -3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -6.7990 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -6.1040 -1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -4.7030 -1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 -3.8780 -0.7830 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -8.3210 -2.5930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6970 -8.6190 -3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 -8.8700 -3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -8.9050 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -10.3980 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -10.8540 -2.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 2.0600 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 2.0150 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 1.9800 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -0.2410 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -0.2860 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -0.0490 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -0.0040 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -2.2930 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -2.3390 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -2.1030 -3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -2.0210 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -4.1250 -3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -6.5700 -3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -6.6620 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -8.6670 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -9.9540 -3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -8.4200 -4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -8.7280 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -8.3960 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -10.9940 -0.1090 O 0 5 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 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 M CHG 1 38 -1 M END