HMDB0002078
     RDKit          3D
Cyanate
  4  3  0  0  0  0  0  0  0  0999 V2000
    1.6856   -0.1513    0.0034 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5489    0.1027   -0.0061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7792    0.3928    0.0055 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4553   -0.3441   -0.0028 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0
  2  3  1  0
  3  4  1  0
M  END