SMILES:c1(c(c(ccn1)C)N)F	

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

              C   1      C   2      N   3      C   4      N   5      F   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.7417     0.0000 
   N   3    0.7468     1.2900     0.0000 
   C   4    1.2864     0.7447     1.4875     0.0000 
   N   5    1.2859     0.7396     1.9677     1.2833     0.0000 
   F   6    0.7432     1.2879     1.2875     1.9673     1.4917     0.0000 
   C   7    1.2875     1.4859     0.7432     1.2843     2.2255     1.9653 
   C   8    1.4859     1.2875     1.2879     0.7411     1.9612     2.2291 
   C   9    1.9648     1.2885     2.2292     0.7417     1.4838     2.5764 

              C   7      C   8      C   9
              ---------------------------------
   C   7    0.0000 
   C   8    0.7417     0.0000 
   C   9    1.9607     1.2822     0.0000 



ATOMIC CHARGES
   C   1    0.2387688507
   C   2    0.1308820981
   N   3   -0.2153389015
   C   4    0.0002265461
   N   5   -0.1243739328
   F   6   -0.1817476587
   C   7    0.1010504741
   C   8    0.0179115911
   C   9    0.0326209329


BOND ANGLES
   8    4    2  Car  Car  Car    120.116
   4    2    1  Car  Car  Car    119.863
   2    4    8  Car  Car  Car    120.116
   4    8    7  Car  Car  Car    120.021


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