HMDB0031159
     RDKit          3D
Garcinia acid
 22 21  0  0  0  0  0  0  0  0999 V2000
    1.7376    2.5463    0.5209 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4278    1.3209    0.3186 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1080    0.4024    1.0749 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4011    1.0896   -0.6850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0752   -0.2989   -0.8829 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0528   -0.2107   -1.9246 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9517   -1.2364   -1.3549 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8632   -1.7744   -2.4874 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0795   -1.5978   -0.6056 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8510   -0.8610    0.3040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0084   -1.0114    1.3908 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9371    0.0692    0.6588 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8248    0.3558   -0.1694 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9749    0.6278    1.9125 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2398    0.5916    2.0599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4928    1.7126   -0.4253 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8216    1.4340   -1.6668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4125    0.6992   -1.9953 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3074   -2.5730   -0.5721 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2227   -1.8758    0.0490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3989   -0.6665    2.2399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6866    1.2566    2.2398 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  1  0
  5  6  1  0
  5  7  1  0
  7  8  2  0
  7  9  1  0
  5 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  2  0
 12 14  1  0
  3 15  1  0
  4 16  1  0
  4 17  1  0
  6 18  1  0
  9 19  1  0
 10 20  1  0
 11 21  1  0
 14 22  1  0
M  END