HMDB0257046
     RDKit          3D
Quinoline-3-carboxylic acid
 20 21  0  0  0  0  0  0  0  0999 V2000
   -4.0320   -1.0288    0.6333 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2794   -0.2322    0.0226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8600    0.7319   -0.7694 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8442   -0.3849    0.1957 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2936   -1.3635    0.9983 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0356   -1.5009    1.1554 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9270   -0.6968    0.5435 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3009   -0.8717    0.7321 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2021   -0.0425    0.1005 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7228    0.9650   -0.7227 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3612    1.1159   -0.8917 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4321    0.3009   -0.2724 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9305    0.4502   -0.4402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7977    1.7253   -0.6227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0043   -2.0244    1.5020 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6740   -1.6612    1.3771 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2650   -0.1987    0.2631 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4535    1.5905   -1.1975 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9778    1.9052   -1.5369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3103    1.2207   -1.0702 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13  4  1  0
 12  7  1  0
  3 14  1  0
  5 15  1  0
  8 16  1  0
  9 17  1  0
 10 18  1  0
 11 19  1  0
 13 20  1  0
M  END