SMILES:n1c(c(cc(c1)N)C)F	

FORMULA: C6H7FN2
MASS: 126.1316
EXACT MASS: 126.0593265
INTERATOMIC DISTANCES

              N   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    0.7426     0.0000 
   C   3    1.2864     0.7458     0.0000 
   C   4    1.4875     1.2935     0.7468     0.0000 
   C   5    0.7391     1.2875     1.4879     1.2915     0.0000 
   C   6    1.2843     1.4879     1.2875     0.7432     0.7458     0.0000 
   F   7    1.2875     0.7391     1.2843     1.9673     1.9637     2.2270 
   N   8    1.9673     2.2347     1.9693     1.2875     1.2935     0.7468 
   C   9    1.9673     1.2915     0.7432     1.2875     2.2311     1.9653 

              F   7      N   8      C   9
              ---------------------------------
   F   7    0.0000 
   N   8    2.9738     0.0000 
   C   9    1.4875     2.5750     0.0000 



ATOMIC CHARGES
   N   1   -0.2152986980
   C   2    0.2183061378
   C   3    0.0254431445
   C   4    0.0191701072
   C   5    0.1192362376
   C   6    0.1080381946
   F   7   -0.1835496352
   N   8   -0.1264357491
   C   9    0.0350902606


BOND ANGLES
   4    3    2  Car  Car  Car    120.143
   3    2    1  Car  Car  Nar    119.589
   2    3    4  Car  Car  Car    120.143
   3    4    6  Car  Car  Car    119.556


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