dipyrithione
  CDK     0223171741
null
 16 17  0  0  0  0  0  0  0  0999 V2000
   -0.3560   -2.3856    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.3580   -1.9723    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0700   -1.9723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0721   -2.3856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0700   -1.1478    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7841   -2.3856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0721   -3.2101    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7841   -1.9723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3560   -0.7365    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7841   -0.7365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5001   -1.9723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3580   -3.6213    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7841   -3.6213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5001   -2.3856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5001   -1.1478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5001   -3.2101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0 
  1  3  1  0  0  0  0 
  2  4  1  0  0  0  0 
  3  5  1  0  0  0  0 
  3  6  2  0  0  0  0 
  4  7  1  0  0  0  0 
  4  8  2  0  0  0  0 
  5  9  1  0  0  0  0 
  5 10  2  0  0  0  0 
  6 11  1  0  0  0  0 
  7 12  1  0  0  0  0 
  7 13  2  0  0  0  0 
  8 14  1  0  0  0  0 
 10 15  1  0  0  0  0 
 11 15  2  0  0  0  0 
 13 16  1  0  0  0  0 
 14 16  2  0  0  0  0 
M  CHG  1   5   1
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  12  -1
M  END