SMILES:n12c(c(cn1)CN)cccc2	

FORMULA: C8H9N3
MASS: 147.1772
EXACT MASS: 147.0796473
INTERATOMIC DISTANCES

              N   1      C   2      N   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    0.8297     0.0000 
   N   3    0.8274     1.3371     0.0000 
   C   4    1.3349     0.8233     1.3303     0.0000 
   C   5    1.3440     1.3399     0.8297     0.8223     0.0000 
   C   6    0.8249     1.4306     1.5137     2.1140     2.1588     0.0000 
   C   7    1.4346     0.8272     2.1201     1.5097     2.1555     1.6512 
   C   8    1.4256     1.6495     2.2284     2.4597     2.7345     0.8181 
   C   9    1.6495     1.4256     2.4635     2.2240     2.7325     1.4267 
   C  10    2.1343     1.4520     2.1490     0.8355     1.4950     2.8639 
   N  11    2.7693     2.2036     2.5651     1.4419     1.7661     3.5558 

              C   7      C   8      C   9      C  10      N  11
              -------------------------------------------------------
   C   7    0.0000 
   C   8    1.4308     0.0000 
   C   9    0.8205     0.8297     0.0000 
   C  10    1.8277     3.0689     2.6403     0.0000 
   N  11    2.6557     3.8490     3.4643     0.8305     0.0000 



ATOMIC CHARGES
   N   1   -0.2284222114
   C   2    0.0818080353
   N   3   -0.1637579345
   C   4    0.0354133192
   C   5    0.1191637629
   C   6    0.1003602193
   C   7    0.0189739003
   C   8    0.0207316471
   C   9    0.0031305065
   C  10    0.1387085584
   N  11   -0.1261098030


BOND ANGLES
   5    4    2  Car  Car  Car    109.027
   4    2    1  Car  Car  Nar    107.722
   7    9    8  Car  Car  Car    120.231
   9    8    6  Car  Car  Car    119.946
   2    4    5  Car  Car  Car    109.027
   4    5    3  Car  Car  Nar    107.268
   8    9    7  Car  Car  Car    120.231
   9    7    2  Car  Car  Car    119.810


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