@MOLECULE 5-(dimethylamino)-2-naphthalenesulfonic acid 30 31 0 0 0 SMALL GASTEIGER @ATOM 1 C -0.8997 1.1160 0.0435 C.ar 1 UNL111111111 -0.0591 2 C -1.5424 -0.0957 0.0748 C.ar 1 UNL111111111 -0.3667 3 C -0.8035 -1.3046 0.0747 C.ar 1 UNL111111111 -0.1086 4 C 0.5663 -1.2709 0.0447 C.ar 1 UNL111111111 -0.1355 5 C 1.2596 -0.0303 0.0158 C.ar 1 UNL111111111 0.0044 6 C 2.6900 0.0437 -0.0051 C.ar 1 UNL111111111 0.1257 7 C 3.3247 1.2653 -0.0282 C.ar 1 UNL111111111 -0.2154 8 C 2.5718 2.4633 -0.0332 C.ar 1 UNL111111111 -0.1368 9 C 1.2025 2.4218 -0.0133 C.ar 1 UNL111111111 -0.1606 10 C 0.5217 1.1736 0.0138 C.ar 1 UNL111111111 -0.0324 11 N 3.3871 -1.2212 0.0008 N.pl3 1 UNL111111111 -0.4032 12 C 4.1750 -1.4013 -1.2382 C.3 1 UNL111111111 -0.2687 13 C 4.2262 -1.3660 1.2103 C.3 1 UNL111111111 -0.2686 14 S -3.2825 -0.1711 0.1214 S.O2 1 UNL111111111 2.4026 15 O -3.7459 -1.4279 0.6543 O.2 1 UNL111111111 -0.9133 16 O -3.5953 -0.2598 -1.5055 O.3 1 UNL111111111 -0.8389 17 O -3.8226 1.0720 0.5999 O.2 1 UNL111111111 -0.8885 18 H -1.4516 2.0643 0.0477 H 1 UNL111111111 0.1766 19 H -1.3246 -2.2676 0.1069 H 1 UNL111111111 0.1754 20 H 1.1562 -2.1923 0.0452 H 1 UNL111111111 0.1825 21 H 4.4115 1.3284 -0.0429 H 1 UNL111111111 0.1633 22 H 3.1032 3.4149 -0.0528 H 1 UNL111111111 0.1606 23 H 0.6157 3.3401 -0.0169 H 1 UNL111111111 0.1627 24 H 4.5581 -2.4357 -1.2603 H 1 UNL111111111 0.1528 25 H 3.5107 -1.2758 -2.1104 H 1 UNL111111111 0.1515 26 H 5.0221 -0.7083 -1.3457 H 1 UNL111111111 0.1244 27 H 3.5999 -1.2070 2.1049 H 1 UNL111111111 0.1516 28 H 4.6027 -2.4025 1.2504 H 1 UNL111111111 0.1530 29 H 5.0827 -0.6780 1.2590 H 1 UNL111111111 0.1243 30 H -4.3985 -0.7198 -1.7733 H 1 UNL111111111 0.3852 @BOND 1 1 2 ar 2 1 10 ar 3 1 18 1 4 2 3 ar 5 2 14 1 6 3 4 ar 7 3 19 1 8 4 5 ar 9 4 20 1 10 5 6 ar 11 5 10 ar 12 6 7 ar 13 6 11 1 14 7 8 ar 15 7 21 1 16 8 9 ar 17 8 22 1 18 9 10 ar 19 9 23 1 20 11 12 1 21 11 13 1 22 12 24 1 23 12 25 1 24 12 26 1 25 13 27 1 26 13 28 1 27 13 29 1 28 14 15 2 29 14 16 1 30 14 17 2 31 16 30 1