HMDB0000426
     RDKit          3D
Citramalic acid
 18 17  0  0  0  0  0  0  0  0999 V2000
   -1.4722   -0.8551    1.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5923   -0.1695   -0.0484 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1226   -0.3891   -1.3045 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7666   -0.8142    0.0661 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7428   -0.2606   -0.8930 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9063   -0.7390   -0.8699 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4602    0.7373   -1.8021 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5947    1.2571    0.2694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0386    2.0658   -0.5564 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1147    1.7183    1.4653 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3688   -0.2872    1.9521 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1185   -1.8920    1.1656 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5283   -0.8800    0.6406 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6649   -1.1197   -1.8078 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6136   -1.8910   -0.2235 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1273   -0.8303    1.1062 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9491    1.6415   -1.8054 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0498    2.7077    1.6384 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  2  8  1  0
  8  9  2  0
  8 10  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  3 14  1  0
  4 15  1  0
  4 16  1  0
  7 17  1  0
 10 18  1  0
M  END