SMILES:c12c([nH]cn1)ncnc2Cl	

FORMULA: C5H3ClN4
MASS: 154.5571
EXACT MASS: 154.0046238
INTERATOMIC DISTANCES

              C   1      C   2      N   3      N   4      C   5      N   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    1.3250     0.0000 
   N   3    2.3292     2.6797     0.0000 
   N   4    2.3025     1.3380     2.3046     0.0000 
   C   5    1.3344     2.3004     3.5499     3.5226     0.0000 
   N   6    2.3004     1.3344     4.0141     2.3208     2.6500     0.0000 
   C   7    2.6797     2.3292     1.3250     1.3417     4.0141     3.5499 
   N   8    2.3333     2.6833     4.6625     4.0213     1.3489     2.3088 
   C   9    2.6833     2.3333     4.8471     3.5580     2.3088     1.3489 
  Cl  10    2.3837     3.5997     4.0624     4.6859     1.4208     4.0708 

              C   7      N   8      C   9     Cl  10
              --------------------------------------------
   C   7    0.0000 
   N   8    4.8471     0.0000 
   C   9    4.6625     1.3250     0.0000 
  Cl  10    4.8764     2.3918     3.6052     0.0000 



ATOMIC CHARGES
   C   1    0.1471073840
   C   2    0.1856644444
   N   3   -0.2184044878
   N   4   -0.2031845106
   C   5    0.1606332999
   N   6   -0.2031644602
   C   7    0.2004542240
   N   8   -0.2107004156
   C   9    0.2011546685
  Cl  10   -0.0595601465


BOND ANGLES
   4    7    3  Nar  Car  Nar    119.590
   7    3    1  Car  Nar  Car     90.000
   6    9    8  Nar  Car  Nar    119.416
   9    8    5  Car  Nar  Car    119.416
   3    7    4  Nar  Car  Nar    119.590
   7    4    2  Car  Nar  Car    120.732
   8    9    6  Nar  Car  Nar    119.416
   9    6    2  Car  Nar  Car    120.817


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