HMDB0253665
     RDKit          3D
Isonitrosoacetone
 11 10  0  0  0  0  0  0  0  0999 V2000
   -1.3797    0.7301   -0.6446 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5901    0.5620    0.5867 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9574    1.1476    1.6310 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5839   -0.2686    0.5671 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9760   -0.8761   -0.4916 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0680   -1.6694   -0.5757 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4888    1.8239   -0.8568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4027    0.2927   -0.5195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8712    0.3006   -1.5195 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1775   -0.4024    1.4695 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8843   -1.6406   -0.0140 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  2  3
  5  6  1  0
  1  7  1  0
  1  8  1  0
  1  9  1  0
  4 10  1  0
  6 11  1  0
M  END