HMDB0253644
     RDKit          3D
Isoguvacine
 18 18  0  0  0  0  0  0  0  0999 V2000
    2.8422    1.0922   -0.2824 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1770    0.0303   -0.1777 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8795   -1.1538   -0.1318 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7107    0.0421   -0.1067 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0711   -1.1104    0.0029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4043   -1.2140    0.0822 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9416    0.0287   -0.4853 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4022    1.0985    0.3675 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0151    1.3548   -0.1617 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3244   -1.4403    0.7320 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6428   -2.0283    0.0371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8064   -2.0550   -0.5059 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7323   -1.2326    1.1460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5626    0.1051   -1.4565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2605    0.7202    1.4033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0229    1.9995    0.3285 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4954    2.1270    0.4577 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0254    1.6361   -1.2492 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  1  0
  7  8  1  0
  8  9  1  0
  9  4  1  0
  3 10  1  0
  5 11  1  0
  6 12  1  0
  6 13  1  0
  7 14  1  0
  8 15  1  0
  8 16  1  0
  9 17  1  0
  9 18  1  0
M  END