HMDB0303335
     RDKit          3D
2-(Methylthio)benzothiazole
 18 19  0  0  0  0  0  0  0  0999 V2000
    4.3191   -0.0234    0.1436 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1439    0.8546    1.2022 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.4764    0.4327    0.6710 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3319    0.8509    1.1694 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7965    0.4375    0.6539 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0840    0.7995    1.0823 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1735    0.2978    0.4596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1502   -0.5670   -0.5947 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8761   -0.9384   -1.0347 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7360   -0.4266   -0.3991 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9646   -0.5962   -0.5886 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.7910   -0.5738   -0.6513 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9973    0.7088   -0.3680 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8989   -0.7564    0.7576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2344    1.4796    1.9100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1703    0.5945    0.8113 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9983   -0.9706   -1.0953 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7040   -1.6037   -1.8441 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11  3  1  0
 10  5  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  6 15  1  0
  7 16  1  0
  8 17  1  0
  9 18  1  0
M  END