@MOLECULE FDBD00818 31 32 0 0 0 SMALL GASTEIGER @ATOM 1 Br 5.5369 2.3949 -0.6544 Br 1 UNK -0.0503 2 O 1.1157 -2.4390 1.3250 O.2 1 UNK -0.2866 3 O1 -4.7540 2.4765 0.7349 O.co2 1 UNK -0.5495 4 O2 -2.9120 2.3047 -0.5810 O.co2 1 UNK -0.5495 5 N -1.1185 0.0629 1.7981 N.pl3 1 UNK -0.3572 6 C -2.6303 -0.4664 -0.0315 C.ar 1 UNK -0.0206 7 C1 -0.4121 -1.3384 -0.0624 C.ar 1 UNK 0.0431 8 C2 -1.3763 -0.5856 0.5676 C.ar 1 UNK 0.0391 9 C3 -3.7191 0.3362 0.6038 C.3 1 UNK 0.0138 10 C4 -2.8867 -1.1038 -1.2454 C.ar 1 UNK -0.0564 11 C5 0.9428 -1.4871 0.5496 C.2 1 UNK 0.1949 12 C6 -0.6353 -1.9796 -1.2613 C.ar 1 UNK -0.0491 13 C7 2.0323 -0.5669 0.2641 C.ar 1 UNK 0.0224 14 C8 -1.8893 -1.8605 -1.8603 C.ar 1 UNK -0.0607 15 C9 1.8316 0.5018 -0.6095 C.ar 1 UNK -0.0499 16 C10 3.2777 -0.7527 0.8641 C.ar 1 UNK -0.0499 17 C11 -3.7241 1.7889 0.1746 C.2 1 UNK 0.0461 18 C12 2.8763 1.3848 -0.8831 C.ar 1 UNK -0.0471 19 C13 4.3225 0.1303 0.5904 C.ar 1 UNK -0.0471 20 C14 4.1217 1.1988 -0.2832 C.ar 1 UNK 0.0179 21 H -1.8239 0.5964 2.2306 H 1 UNK 0.1423 22 H1 -0.2337 -0.0193 2.2219 H 1 UNK 0.1423 23 H2 -3.5942 0.2967 1.6657 H 1 UNK 0.0374 24 H3 -4.6494 -0.0892 0.2900 H 1 UNK 0.0374 25 H4 -3.8145 -1.0155 -1.6886 H 1 UNK 0.0621 26 H5 0.1103 -2.5367 -1.7071 H 1 UNK 0.0625 27 H6 -2.0791 -2.3322 -2.7583 H 1 UNK 0.0618 28 H7 0.9102 0.6393 -1.0535 H 1 UNK 0.0625 29 H8 3.4262 -1.5434 1.5105 H 1 UNK 0.0625 30 H9 2.7277 2.1756 -1.5293 H 1 UNK 0.0629 31 H10 5.2439 -0.0071 1.0343 H 1 UNK 0.0629 @BOND 1 1 20 1 2 2 11 2 3 3 17 ar 4 4 17 ar 5 5 8 1 6 6 8 ar 7 6 9 1 8 6 10 ar 9 7 8 ar 10 7 11 1 11 7 12 ar 12 9 17 1 13 10 14 ar 14 11 13 1 15 12 14 ar 16 13 15 ar 17 13 16 ar 18 15 18 ar 19 16 19 ar 20 18 20 ar 21 19 20 ar 22 5 21 1 23 5 22 1 24 9 23 1 25 9 24 1 26 10 25 1 27 12 26 1 28 14 27 1 29 15 28 1 30 16 29 1 31 18 30 1 32 19 31 1