@MOLECULE benzenesulfonic acid 16 16 0 0 0 SMALL GASTEIGER @ATOM 1 S 1.4028 0.0188 -0.1295 S.O2 1 UNL1111 2.3978 2 O 1.7367 -0.0487 1.4932 O.3 1 UNL1111 -0.8375 3 O 1.9150 -1.2198 -0.6604 O.2 1 UNL1111 -0.9111 4 O 1.8729 1.2846 -0.6205 O.2 1 UNL1111 -0.8795 5 C -0.3390 0.0045 -0.0653 C.ar 1 UNL1111 -0.3896 6 C -1.0405 1.2090 -0.0138 C.ar 1 UNL1111 -0.0556 7 C -1.0269 -1.2090 -0.0685 C.ar 1 UNL1111 -0.0584 8 C -2.4335 1.1985 0.0386 C.ar 1 UNL1111 -0.1820 9 C -2.4198 -1.2165 -0.0153 C.ar 1 UNL1111 -0.1826 10 C -3.1222 -0.0135 0.0396 C.ar 1 UNL1111 -0.0916 11 H -0.5128 2.1706 -0.0198 H 1 UNL1111 0.1739 12 H -0.4888 -2.1629 -0.1189 H 1 UNL1111 0.1714 13 H -2.9828 2.1372 0.0783 H 1 UNL1111 0.1555 14 H -2.9577 -2.1623 -0.0167 H 1 UNL1111 0.1548 15 H -4.2105 -0.0202 0.0820 H 1 UNL1111 0.1475 16 H 2.5517 -0.4956 1.7538 H 1 UNL1111 0.3870 @BOND 1 1 2 1 2 1 3 2 3 1 4 2 4 1 5 1 5 2 16 1 6 5 6 ar 7 5 7 ar 8 6 8 ar 9 6 11 1 10 7 9 ar 11 7 12 1 12 8 10 ar 13 8 13 1 14 9 10 ar 15 9 14 1 16 10 15 1