@MOLECULE 2-hydroxynicotinicacid 15 15 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -0.0276 -2.0802 0.2418 O.2 1 UNL1 -0.4535 2 O 2.2253 -0.7932 -0.5012 O.3 1 UNL1 -0.5076 3 O 2.3876 1.2455 0.3853 O.2 1 UNL1 -0.5241 4 N -1.9038 -0.8786 0.0389 N.ar 1 UNL1 -0.4844 5 C 0.2234 0.3034 0.0091 C.ar 1 UNL1 -0.3531 6 C -0.4632 -0.9643 0.1013 C.ar 1 UNL1 0.5967 7 C -0.4622 1.4894 -0.0779 C.ar 1 UNL1 0.0931 8 C -1.8740 1.5018 -0.1213 C.ar 1 UNL1 -0.3722 9 C -2.5632 0.3099 -0.0710 C.ar 1 UNL1 0.1519 10 C 1.6860 0.3342 0.0156 C.2 1 UNL1 0.6653 11 H 0.0844 2.4409 -0.1205 H 1 UNL1 0.1750 12 H -2.4155 -1.7573 0.0854 H 1 UNL1 0.3231 13 H -2.4037 2.4458 -0.1979 H 1 UNL1 0.1798 14 H -3.6601 0.2728 -0.1141 H 1 UNL1 0.1610 15 H 3.2169 -0.7941 -0.4749 H 1 UNL1 0.3491 @BOND 1 2 15 1 2 2 10 1 3 13 8 1 4 8 7 ar 5 8 9 ar 6 11 7 1 7 14 9 1 8 7 5 ar 9 9 4 ar 10 5 10 1 11 5 6 ar 12 10 3 2 13 4 12 1 14 4 6 ar 15 6 1 2