SMILES:c1ccc(c(c1C)C(=O)Nc1c(cccc1)C)N	

FORMULA: C15H16N2O
MASS: 240.3003
EXACT MASS: 240.1262631
INTERATOMIC DISTANCES

              C   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.8274     0.0000 
   C   3    1.4310     0.8255     0.0000 
   C   4    1.6520     1.4312     0.8271     0.0000 
   C   5    1.4273     1.6525     1.4341     0.8305     0.0000 
   C   6    0.8229     1.4305     1.6530     1.4326     0.8241     0.0000 
   C   7    1.4266     2.1839     2.4780     2.1868     1.4277     0.8250 
   N   8    2.4770     2.1854     1.4316     0.8251     1.4345     2.1864 
   C   9    2.1808     2.4775     2.1880     1.4339     0.8250     1.4283 
   N  10    2.8562     2.9772     2.4801     1.6530     1.4289     2.1820 
   O  11    2.4727     2.9769     2.8630     2.1881     1.4290     1.6498 
   C  12    3.5942     3.7832     3.3051     2.4780     2.1827     2.8572 
   C  13    4.2835     4.3658     3.7827     2.9739     2.8562     3.5941 
   C  14    5.0141     5.1517     4.5949     3.7794     3.5935     4.2841 
   C  15    5.1477     5.4097     4.9521     4.1250     3.7780     4.3628 
   C  16    4.5838     4.9451     4.5914     3.7772     3.2925     3.7729 
   C  17    3.7738     4.1222     3.7802     2.9728     2.4697     2.9697 
   C  18    4.3613     4.2857     3.5962     2.8545     2.9720     3.7775 

              C   7      N   8      C   9      N  10      O  11      C  12
              ------------------------------------------------------------------
   C   7    0.0000 
   N   8    2.8622     0.0000 
   C   9    1.6486     1.6571     0.0000 
   N  10    2.4736     1.4357     0.8250     0.0000 
   O  11    1.4277     2.4821     0.8250     1.4289     0.0000 
   C  12    2.9732     2.1889     1.4289     0.8250     1.6500     0.0000 
   C  13    3.7788     2.4764     2.1818     1.4273     2.4753     0.8253 
   C  14    4.3629     3.3007     2.8558     2.1799     2.9737     1.4269 
   C  15    4.2839     3.7828     2.9721     2.4719     2.8562     1.6469 
   C  16    3.5879     3.5958     2.4675     2.1758     2.1756     1.4226 
   C  17    2.8534     2.8586     1.6447     1.4229     1.4257     0.8199 
   C  18    4.1221     2.1810     2.4736     1.6486     2.9743     1.4301 

              C  13      C  14      C  15      C  16      C  17      C  18
              ------------------------------------------------------------------
   C  13    0.0000 
   C  14    0.8243     0.0000 
   C  15    1.4291     0.8259     0.0000 
   C  16    1.6500     1.4319     0.8292     0.0000 
   C  17    1.4284     1.6506     1.4305     0.8229     0.0000 
   C  18    0.8250     1.4291     2.1836     2.4750     2.1811     0.0000 




ATOMIC CHARGES
   C   1   -0.0040266926
   C   2    0.0010648210
   C   3    0.0181846898
   C   4    0.0931811958
   C   5    0.0681492515
   C   6   -0.0160972552
   C   7    0.0312210288
   N   8   -0.1279168870
   C   9    0.2699733642
   N  10   -0.1757374154
   O  11   -0.2679728815
   C  12    0.0696952052
   C  13   -0.0064997236
   C  14   -0.0029724121
   C  15   -0.0002383063
   C  16    0.0013146236
   C  17    0.0162868254
   C  18    0.0323905685


BOND ANGLES
   6    5    9  Car  Car   C2    120.020
   5    9   10  Car   C2  Nam    119.999
   5    9   11  Car   C2   O2    120.002
   8    4    5  Npl  Car  Car    120.102
   4    5    9  Car  Car   C2    120.024
   4    5    6  Car  Car  Car    119.956
  11    9   10   O2   C2  Nam    120.000
   9   10   12   C2  Nam  Car    119.999
  10    9   11  Nam   C2   O2    120.000
   9    5    6   C2  Car  Car    120.020
   5    6    1  Car  Car  Car    120.135
   5    6    7  Car  Car   C3    119.937
   7    6    1   C3  Car  Car    119.928
   6    1    2  Car  Car  Car    120.178
  18   13   14   C3  Car  Car    120.112
  13   14   15  Car  Car  Car    120.002
   1    6    7  Car  Car   C3    119.928
   5    4    8  Car  Car  Npl    120.102
  14   13   18  Car  Car   C3    120.112


TORSION ANGLES
   4    5    9   10      0.026
   4    5    9   11    179.974
   6    5    9   10    179.974
   6    5    9   11      0.026
   3    4    5    9    179.974
   3    4    5    6      0.026
   8    4    5    9      0.026
   8    4    5    6    179.974
   5    9   10   12    179.974
  11    9   10   12      0.026
   1    2    3    4      0.026
   9    5    6    1    179.974
   9    5    6    7      0.026
   4    5    6    1      0.026
   4    5    6    7    179.974
   9   10   12   13    179.974
   9   10   12   17      0.026
   5    6    1    2      0.026
   7    6    1    2    179.974
  10   12   13   14    179.974
  10   12   13   18      0.026
  17   12   13   14      0.026
  17   12   13   18    179.974
   6    1    2    3      0.026
  12   13   14   15      0.026
  18   13   14   15    179.974
  13   14   15   16      0.026
   2    3    4    5      0.026
   2    3    4    8    179.974
  14   15   16   17      0.026
  15   16   17   12      0.026
  16   17   12   10    179.974
  16   17   12   13      0.026