SMILES:n1c(c(ccc1C)N)OC	

FORMULA: C7H10N2O
MASS: 138.1671
EXACT MASS: 138.0793130
INTERATOMIC DISTANCES

              N   1      C   2      C   3      C   4      C   5      O   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    0.7447     0.0000 
   C   3    1.2935     0.7500     0.0000 
   C   4    0.7411     1.2875     1.4900     0.0000 
   C   5    1.4875     1.2900     0.7426     1.2879     0.0000 
   O   6    1.2875     0.7411     1.2915     1.9645     1.9673     0.0000 
   N   7    1.9736     1.2951     0.7432     2.2333     1.2875     1.4958 
   C   8    1.2843     1.4859     1.2875     0.7417     0.7432     2.2270 
   C   9    1.2875     1.9685     2.2347     0.7447     1.9673     2.5750 
   C  10    1.4859     1.2843     1.9699     2.2270     2.5743     0.7417 

              N   7      C   8      C   9      C  10
              --------------------------------------------
   N   7    0.0000 
   C   8    1.9669     0.0000 
   C   9    2.9779     1.2864     0.0000 
   C  10    2.2375     2.6758     2.6797     0.0000 



ATOMIC CHARGES
   N   1   -0.2148945898
   C   2    0.2418552988
   C   3    0.1420365740
   C   4    0.0625458462
   C   5    0.0240253957
   O   6   -0.4552215094
   N   7   -0.1231660394
   C   8    0.0163446274
   C   9    0.0521992689
   C  10    0.2542751277


BOND ANGLES
   5    3    2  Car  Car  Car    119.589
   3    2    1  Car  Car  Nar    119.863
   2    3    5  Car  Car  Car    119.589
   3    5    8  Car  Car  Car    120.110


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