SMILES:S(=O)(=O)(c1csnc1)N	

FORMULA: C3H4N2O2S2
MASS: 164.2061
EXACT MASS: 163.9714194
INTERATOMIC DISTANCES

              S   1      C   2      N   3      C   4      S   5      C   6
              ------------------------------------------------------------------
   S   1    0.0000 
   C   2    0.8258     0.0000 
   N   3    2.1305     1.3366     0.0000 
   C   4    1.4881     0.8262     1.3334     0.0000 
   S   5    2.1460     1.3394     0.8269     0.8250     0.0000 
   C   6    1.4530     0.8222     0.8277     1.3319     1.3381     0.0000 
   O   7    0.8228     1.1554     2.0961     1.9789     2.4121     1.2749 
   O   8    0.8229     1.1636     2.4425     1.3489     2.1615     1.9765 
   N   9    0.8199     1.6456     2.9344     2.2582     2.9587     2.2067 

              O   7      O   8      N   9
              ---------------------------------
   O   7    0.0000 
   O   8    1.6456     0.0000 
   N   9    1.1636     1.1720     0.0000 



ATOMIC CHARGES
   S   1    0.0955610405
   C   2    0.1526172594
   N   3   -0.2061568753
   C   4    0.0763724108
   S   5    0.0149998299
   C   6    0.1277891475
   O   7   -0.1502296941
   O   8   -0.1502296941
   N   9    0.0392765755


BOND ANGLES
   5    3    6   S2  Nar  Car    107.940
   3    6    2  Nar  Car  Car    108.211
   6    3    5  Car  Nar   S2    107.940
   3    5    4  Nar   S2  Car    107.638


TORSION ANGLES
   4    2    1    7    179.974
   4    2    1    8      0.026
   4    2    1    9    179.974
   6    2    1    7      0.026
   6    2    1    8    179.974
   6    2    1    9      0.026
   5    3    6    2      0.026
   5    4    2    1    179.974
   5    4    2    6      0.026
   3    5    4    2      0.026
   3    6    2    1    179.974
   3    6    2    4      0.026
   6    3    5    4      0.026