B6112.sdf
  ChemDraw07181711532D

 13 11  0  0  0  0  0  0  0  0999 V2000
    0.8923   -0.6947    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6880    0.1046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9106    0.8990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7099    1.1034    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.3340    1.4890    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4823   -0.1180    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1113   -0.0997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3340   -0.8941    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1333   -1.0985    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9326   -1.3029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3376   -0.2992    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9289   -1.8978    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9326    1.8978    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
  2  1  1  1      
  2  3  1  0      
  3  4  1  0      
  3  5  2  0      
  2  6  1  6      
  2  7  1  0      
  7  8  1  0      
  8  9  1  0      
  9 10  1  0      
  9 11  2  0      
  9 12  2  0      
M  CHG  2   4  -1  13   1
M  END
$$$$
