SMILES:n1c(c(ccc1Cl)N)Cl	

FORMULA: C5H4Cl2N2
MASS: 163.0047
EXACT MASS: 161.9751535
INTERATOMIC DISTANCES

              N   1      C   2      C   3      C   4      C   5     Cl   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    0.7504     0.0000 
   C   3    0.7504     1.3000     0.0000 
   C   4    1.2993     0.7500     1.5008     0.0000 
   C   5    1.5000     1.2993     1.2993     0.7504     0.0000 
  Cl   6    1.2917     0.7432     1.9776     1.2951     1.9795     0.0000 
   C   7    1.2993     1.5008     0.7500     1.3000     0.7504     2.2441 
   N   8    1.9795     1.2951     2.2441     0.7432     1.2917     1.5000 
  Cl   9    1.3000     1.9857     0.7504     2.2512     1.9849     2.5917 

              C   7      N   8     Cl   9
              ---------------------------------
   C   7    0.0000 
   N   8    1.9776     0.0000 
  Cl   9    1.2993     2.9945     0.0000 



ATOMIC CHARGES
   N   1   -0.2211716051
   C   2    0.1558567521
   C   3    0.1393733972
   C   4    0.1175037812
   C   5    0.0229198321
  Cl   6   -0.0598626450
   C   7    0.0322483205
   N   8   -0.1255649563
  Cl   9   -0.0613028767


BOND ANGLES
   5    4    2  Car  Car  Car    119.982
   4    2    1  Car  Car  Nar    119.982
   2    4    5  Car  Car  Car    119.982
   4    5    7  Car  Car  Car    120.037


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