@MOLECULE 4-(bromomethyl)-7-methoxy-2h-chromen-2-one 24 25 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 BR -2.9069 1.0143 -0.3960 Br 1 UNL1 -0.0654 2 O 1.2982 -2.1367 -0.2156 O.2 1 UNL1 -0.3682 3 O 4.0362 1.7317 -0.0907 O.3 1 UNL1 -0.2982 4 O 0.1223 -3.9663 -0.3211 O.2 1 UNL1 -0.4048 5 C 0.3314 -0.0340 0.4786 C.ar 1 UNL1 -0.2841 6 C -0.9392 -0.6855 0.6624 C.ar 1 UNL1 0.1769 7 C 1.4109 -0.8201 0.0338 C.ar 1 UNL1 0.3700 8 C 0.5710 1.3382 0.7023 C.ar 1 UNL1 0.0053 9 C 2.6947 -0.2974 -0.1810 C.ar 1 UNL1 -0.4112 10 C 2.8781 1.0563 0.0588 C.ar 1 UNL1 0.3377 11 C -1.0558 -2.0102 0.4040 C.ar 1 UNL1 -0.3906 12 C 1.8170 1.8862 0.5013 C.ar 1 UNL1 -0.3119 13 C -2.1195 0.0858 1.1362 C.3 1 UNL1 -0.2788 14 C 0.0652 -2.7995 -0.0534 C.ar 1 UNL1 0.6026 15 C 5.1694 0.9965 -0.5425 C.3 1 UNL1 -0.2034 16 H -0.2464 1.9801 1.0382 H 1 UNL1 0.1567 17 H 3.4869 -0.9554 -0.5224 H 1 UNL1 0.1962 18 H -1.9915 -2.5578 0.5162 H 1 UNL1 0.1966 19 H 2.0102 2.9429 0.6703 H 1 UNL1 0.1811 20 H -2.9143 -0.5536 1.5609 H 1 UNL1 0.1777 21 H -1.8692 0.8504 1.8912 H 1 UNL1 0.1749 22 H 5.9478 1.7713 -0.5757 H 1 UNL1 0.1558 23 H 5.4369 0.2131 0.1741 H 1 UNL1 0.1420 24 H 4.9936 0.5848 -1.5418 H 1 UNL1 0.1431 @BOND 1 24 15 1 2 22 15 1 3 15 3 1 4 15 23 1 5 17 9 1 6 1 13 1 7 4 14 2 8 2 14 ar 9 2 7 ar 10 9 7 ar 11 9 10 ar 12 3 10 1 13 14 11 ar 14 7 5 ar 15 10 12 ar 16 11 18 1 17 11 6 ar 18 5 6 ar 19 5 8 ar 20 12 19 1 21 12 8 ar 22 6 13 1 23 8 16 1 24 13 20 1 25 13 21 1