SMILES:c1(c(c(ncc1)Cl)Cl)[B](O)O	

FORMULA: C5H4BCl2NO2
MASS: 191.8078
EXACT MASS: 190.9712141
INTERATOMIC DISTANCES

              C   1      C   2      B   3      C   4      N   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    1.5287     0.0000 
   B   3    1.5375     2.6544     0.0000 
   C   4    2.6688     1.5542     4.0756     0.0000 
   N   5    3.0667     2.6580     4.6042     1.5225     0.0000 
   C   6    1.5251     2.6458     2.6523     3.0685     2.6559     0.0000 
  Cl   7    2.6292     1.5107     3.0458     2.6586     4.0395     4.0229 
  Cl   8    4.0648     2.6767     5.3310     1.5213     2.6294     4.5898 
   O   9    2.6533     4.0453     1.5185     5.3221     5.5319     3.0708 
   O  10    2.6616     3.0708     1.5329     4.6250     5.5359     4.0534 
   C  11    2.6523     3.0601     4.0584     2.6459     1.5272     1.5375 

             Cl   7     Cl   8      O   9      O  10      C  11
              -------------------------------------------------------
  Cl   7    0.0000 
  Cl   8    3.1000     0.0000 
   O   9    4.5642     6.6898     0.0000 
   O  10    2.6513     5.5633     2.6333     0.0000 
   C  11    4.5708     4.0302     4.6083     5.3138     0.0000 



ATOMIC CHARGES
   C   1    0.0000000000
   C   2    0.0000000000
   B   3    0.0000000000
   C   4    0.0000000000
   N   5    0.0000000000
   C   6    0.0000000000
  Cl   7    0.0000000000
  Cl   8    0.0000000000
   O   9    0.0000000000
   O  10    0.0000000000
   C  11    0.0000000000


BOND ANGLES
   4    5   11  Car  Nar  Car    120.354
   5   11    6  Nar  Car  Car    120.134
  11    5    4  Car  Nar  Car    120.354
   5    4    2  Nar  Car  Car    119.511


TORSION ANGLES
   4    2    1    3    179.974
   4    2    1    6      0.026
   7    2    1    3      0.026
   7    2    1    6    179.974
   9    3    1    2    179.974
   9    3    1    6      0.026
  10    3    1    2      0.026
  10    3    1    6    179.974
   8    4    2    1    179.974
   8    4    2    7      0.026
   5    4    2    1      0.026
   5    4    2    7    179.974
   4    5   11    6      0.026
  11    6    1    2      0.026
  11    6    1    3    179.974
   5   11    6    1      0.026
  11    5    4    2      0.026
  11    5    4    8    179.974