@MOLECULE 5-amino-6-hydroxy-2-naphthalenesulfonic acid 25 26 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.1309 -0.0741 0.1073 S.O2 1 UNL1111111111 2.4041 2 O 4.9453 -0.2173 -0.1136 O.3 1 UNL1111111111 -0.4758 3 O -3.3973 -0.2614 -1.5196 O.3 1 UNL1111111111 -0.8403 4 O -3.4724 -1.3153 0.7460 O.2 1 UNL1111111111 -0.8849 5 O -3.8116 1.1483 0.4549 O.2 1 UNL1111111111 -0.9138 6 N 3.3886 1.9706 0.0521 N.pl3 1 UNL1111111111 -0.5838 7 C 1.3816 0.5361 0.0273 C.ar 1 UNL1111111111 -0.0101 8 C 0.8468 -0.7737 0.0480 C.ar 1 UNL1111111111 -0.0421 9 C -1.4027 0.1378 0.0891 C.ar 1 UNL1111111111 -0.3871 10 C -0.5671 -0.9481 0.0764 C.ar 1 UNL1111111111 -0.0331 11 C 2.8010 0.7029 -0.0161 C.ar 1 UNL1111111111 0.1061 12 C 0.4869 1.6431 0.0617 C.ar 1 UNL1111111111 -0.1630 13 C -0.8691 1.4514 0.0888 C.ar 1 UNL1111111111 -0.0894 14 C 1.7033 -1.9044 0.0442 C.ar 1 UNL1111111111 -0.1531 15 C 3.6007 -0.4427 -0.0313 C.ar 1 UNL1111111111 0.1479 16 C 3.0664 -1.7430 0.0082 C.ar 1 UNL1111111111 -0.2149 17 H -0.9534 -1.9753 0.0932 H 1 UNL1111111111 0.1739 18 H 0.8919 2.6535 0.0839 H 1 UNL1111111111 0.1547 19 H -1.5432 2.3152 0.1233 H 1 UNL1111111111 0.1752 20 H 1.2641 -2.9010 0.0697 H 1 UNL1111111111 0.1633 21 H 3.7352 -2.6012 0.0024 H 1 UNL1111111111 0.1655 22 H 2.9039 2.7217 -0.3995 H 1 UNL1111111111 0.2811 23 H 4.3859 1.9966 -0.0869 H 1 UNL1111111111 0.3005 24 H 5.4589 -1.0548 -0.0195 H 1 UNL1111111111 0.3328 25 H -4.2448 0.0416 -1.8642 H 1 UNL1111111111 0.3862 @BOND 1 1 3 1 2 1 4 2 3 1 5 2 4 1 9 1 5 2 15 1 6 2 24 1 7 3 25 1 8 6 11 1 9 6 22 1 10 6 23 1 11 7 8 ar 12 7 11 ar 13 7 12 ar 14 8 10 ar 15 8 14 ar 16 9 10 ar 17 9 13 ar 18 10 17 1 19 11 15 ar 20 12 13 ar 21 12 18 1 22 13 19 1 23 14 16 ar 24 14 20 1 25 15 16 ar 26 16 21 1