9 C -2.61000 1.16500 0.02080 C -1.31530 1.93620 0.01880 O -1.33160 3.14390 0.02550 C -0.01440 1.20850 0.00870 O 0.00210 -0.00410 0.00200 Br -4.12150 2.42210 0.03480 H -2.65900 0.59390 -0.79860 H -2.65500 0.53280 0.90750 O 1.14190 1.89720 0.00130