SMILES:c1(c2c([nH]c1)cccc2Cl)C(=O)C	

FORMULA: C10H8ClNO
MASS: 193.6296
EXACT MASS: 193.0294416
INTERATOMIC DISTANCES

              C   1      C   2      C   3      N   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.8275     0.0000 
   C   3    0.8258     1.3401     0.0000 
   N   4    1.3416     1.3427     0.8326     0.0000 
   C   5    1.3427     0.8334     1.3427     0.8275     0.0000 
   C   6    0.8285     1.5430     1.3898     2.1025     2.1681     0.0000 
   C   7    1.5124     0.8268     2.1557     2.1242     1.4373     1.9935 
   O   8    1.4335     1.8570     2.1587     2.7750     2.6373     0.8275 
   C   9    2.1242     1.4373     2.1589     1.5124     0.8268     2.9309 
   C  10    2.2321     1.4291     2.7341     2.4653     1.6501     2.8032 
   C  11    2.4690     1.6544     2.7367     2.2311     1.4291     3.1876 
   C  12    1.4286     2.2438     1.5753     2.4032     2.7119     0.8250 
  Cl  13    1.8010     1.4324     2.5899     2.7717     2.1929     1.9351 

              C   7      O   8      C   9      C  10      C  11      C  12
              ------------------------------------------------------------------
   C   7    0.0000 
   O   8    1.9623     0.0000 
   C   9    1.6584     3.2909     0.0000 
   C  10    0.8275     2.7810     1.4280     0.0000 
   C  11    1.4352     3.3486     0.8233     0.8250     0.0000 
   C  12    2.7947     1.4352     3.5251     3.5874     3.8952     0.0000 
  Cl  13    0.8250     1.5625     2.4834     1.4329     2.1885     2.7547 

             Cl  13
              -----------
  Cl  13    0.0000 



ATOMIC CHARGES
   C   1    0.0560730164
   C   2    0.0324800016
   C   3    0.1017008305
   N   4   -0.2437149249
   C   5    0.0822596883
   C   6    0.1750630253
   C   7    0.0592337126
   O   8   -0.2912730877
   C   9    0.0191528555
   C  10    0.0114936831
   C  11    0.0024101478
   C  12    0.0773144551
  Cl  13   -0.0821934037


BOND ANGLES
   5    4    3  Car  Nar  Car    107.954
   4    3    1  Nar  Car  Car    107.983
  13    7    2   Cl  Car  Car    120.253
   7    2    1  Car  Car  Car    132.191
   9   11   10  Car  Car  Car    120.069
  11   10    7  Car  Car  Car    120.572
   3    4    5  Car  Nar  Car    107.954
   4    5    2  Nar  Car  Car    107.883
  10   11    9  Car  Car  Car    120.069
  11    9    5  Car  Car  Car    120.005
   2    7   13  Car  Car   Cl    120.253


TORSION ANGLES
   5    2    1    3      0.026
   5    2    1    6    179.974
   7    2    1    3    179.974
   7    2    1    6      0.026
   4    3    1    2      0.026
   4    3    1    6    179.974
   5    4    3    1      0.026
   9    5    2    1    179.974
   9    5    2    7      0.026
   4    5    2    1      0.026
   4    5    2    7    179.974
   8    6    1    2      0.026
   8    6    1    3    179.974
  12    6    1    2    179.974
  12    6    1    3      0.026
  10    7    2    1    179.974
  10    7    2    5      0.026
  13    7    2    1      0.026
  13    7    2    5    179.974
  11    9    5    2      0.026
  11    9    5    4    179.974
  11   10    7    2      0.026
  11   10    7   13    179.974
   9   11   10    7      0.026
   3    4    5    2      0.026
   3    4    5    9    179.974
  10   11    9    5      0.026