@MOLECULE 2,4-difluoro-5-nitrobenzenesulfonic acid 18 18 0 0 0 SMALL GASTEIGER @ATOM 1 S -2.3566 0.6371 -0.1031 S.O2 1 UNL1111111111 2.4326 2 F -1.5848 -2.2313 -0.0524 F 1 UNL1111111111 -0.1236 3 F 3.0334 -1.6604 0.0311 F 1 UNL1111111111 -0.1042 4 O -2.8277 0.1916 1.4154 O.3 1 UNL1111111111 -0.8361 5 O -2.2474 2.0646 -0.1621 O.2 1 UNL1111111111 -0.8653 6 O -3.2015 -0.0969 -1.0001 O.2 1 UNL1111111111 -0.8862 7 O 2.5920 2.3359 -0.0113 O.2 1 UNL1111111111 -0.3896 8 O 3.9157 0.6349 0.0286 O.2 1 UNL1111111111 -0.3659 9 N 2.8079 1.1357 0.0021 N.pl3 1 UNL1111111111 0.6413 10 C -0.7399 -0.0478 -0.0650 C.ar 1 UNL1111111111 -0.5132 11 C 0.3687 0.7930 -0.0446 C.ar 1 UNL1111111111 0.0741 12 C 1.6582 0.2478 -0.0152 C.ar 1 UNL1111111111 -0.2274 13 C -0.5383 -1.4319 -0.0435 C.ar 1 UNL1111111111 0.3553 14 C 1.8232 -1.1487 0.0015 C.ar 1 UNL1111111111 0.3248 15 C 0.7305 -2.0114 -0.0126 C.ar 1 UNL1111111111 -0.3430 16 H 0.2530 1.8974 -0.0537 H 1 UNL1111111111 0.2222 17 H 0.8634 -3.0966 0.0022 H 1 UNL1111111111 0.2104 18 H -3.7577 -0.0383 1.5469 H 1 UNL1111111111 0.3939 @BOND 1 1 4 1 2 1 5 2 3 1 6 2 4 1 10 1 5 2 13 1 6 3 14 1 7 4 18 1 8 7 9 2 9 8 9 2 10 9 12 1 11 10 11 ar 12 10 13 ar 13 11 12 ar 14 11 16 1 15 12 14 ar 16 13 15 ar 17 14 15 ar 18 15 17 1