SMILES:c1c(nc(c(n1)Cl)Cl)Cl	

FORMULA: C4HCl3N2
MASS: 183.4231
EXACT MASS: 181.9205311
INTERATOMIC DISTANCES

              C   1      C   2      N   3      C   4      C   5      N   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.8274     0.0000 
   N   3    1.4310     0.8255     0.0000 
   C   4    1.6520     1.4312     0.8271     0.0000 
   C   5    1.4273     1.6525     1.4341     0.8305     0.0000 
   N   6    0.8229     1.4305     1.6530     1.4326     0.8241     0.0000 
  Cl   7    2.1808     2.4775     2.1880     1.4339     0.8250     1.4283 
  Cl   8    2.4770     2.1854     1.4316     0.8251     1.4345     2.1864 
  Cl   9    1.4312     0.8250     1.4296     2.1853     2.4775     2.1835 

             Cl   7     Cl   8     Cl   9
              ---------------------------------
  Cl   7    0.0000 
  Cl   8    1.6571     0.0000 
  Cl   9    3.3025     2.8612     0.0000 



ATOMIC CHARGES
   C   1    0.1305933170
   C   2    0.1584184478
   N   3   -0.2185201826
   C   4    0.1675356563
   C   5    0.1666743675
   N   6   -0.2275063893
  Cl   7   -0.0587937217
  Cl   8   -0.0587617879
  Cl   9   -0.0596397070


BOND ANGLES
   8    4    5   Cl  Car  Car    120.102
   4    5    6  Car  Car  Nar    119.956
   4    5    7  Car  Car   Cl    120.024
   9    2    3   Cl  Car  Nar    120.035
   2    3    4  Car  Nar  Car    120.000
   7    5    6   Cl  Car  Nar    120.020
   5    6    1  Car  Nar  Car    120.135
   6    5    7  Nar  Car   Cl    120.020
   5    4    8  Car  Car   Cl    120.102
   3    2    9  Nar  Car   Cl    120.035


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