HMDB0253696
     RDKit          3D
Isothiazole
  8  8  0  0  0  0  0  0  0  0999 V2000
    0.1123   -0.6509   -0.0325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0955   -0.0270    0.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1139    1.2981    0.0664 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5092    1.7213    0.0845 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2034    0.1759    0.0066 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2052   -1.7710   -0.0883 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0670   -0.5939   -0.0259 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2463   -0.1525   -0.0115 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  5  1  2  0
  1  6  1  0
  2  7  1  0
  5  8  1  0
M  END