SMILES:c1(c(CCN2CCCC2)cccc1OC)N	

FORMULA: C13H20N2O
MASS: 220.3107
EXACT MASS: 220.1575633
INTERATOMIC DISTANCES

              C   1      N   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   N   2    4.2172     0.0000 
   C   3    1.4042     3.7181     0.0000 
   C   4    1.4001     5.6173     2.4285     0.0000 
   C   5    2.4399     2.4292     1.4114     3.7190     0.0000 
   C   6    2.8172     1.4001     2.4375     4.2172     1.4037     0.0000 
   N   7    1.4052     3.7132     2.4291     2.4333     2.8083     2.4342 
   O   8    2.4321     6.4389     3.7159     1.4083     4.8720     5.0713 
   C   9    5.1341     1.5008     4.9502     6.4985     3.8039     2.5130 
   C  10    5.3360     1.5052     4.5132     6.7107     3.1023     2.6492 
   C  11    2.8058     6.1203     2.4292     2.4306     3.7181     4.8667 
   C  12    2.4357     4.8625     1.4042     2.8125     2.4333     3.7165 
   C  13    2.4292     6.4358     2.8058     1.4037     4.2172     5.0675 
   C  14    2.8000     6.1201     4.2042     2.4249     5.0619     4.8669 
   C  15    6.5081     2.4259     6.1384     7.8950     4.8484     3.7485 
   C  16    6.6108     2.4278     5.9301     8.0073     4.5322     3.8079 

              N   7      O   8      C   9      C  10      C  11      C  12
              ------------------------------------------------------------------
   N   7    0.0000 
   O   8    2.8136     0.0000 
   C   9    4.2595     7.0727     0.0000 
   C  10    5.0789     7.6872     2.4394     0.0000 
   C  11    4.2110     3.7173     7.3793     6.7425     0.0000 
   C  12    3.7158     4.2208     6.2080     5.3691     1.4079     0.0000 
   C  13    3.7157     2.4342     7.5039     7.3188     1.4042     2.4378 
   C  14    2.4327     1.3959     6.4675     7.5102     4.8555     5.0599 
   C  15    5.7290     8.5412     1.4987     2.4399     8.5461     7.2794 
   C  16    6.1301     8.8663     2.4312     1.5079     8.2186     6.8588 

              C  13      C  14      C  15      C  16
              --------------------------------------------
   C  13    0.0000 
   C  14    3.7069     0.0000 
   C  15    8.8153     7.9655     0.0000 
   C  16    8.7225     8.5145     1.5053     0.0000 



ATOMIC CHARGES
   C   1    0.1189317002
   N   2   -0.2723765745
   C   3   -0.0010527386
   C   4    0.1549915648
   C   5    0.0451360024
   C   6    0.0768507431
   N   7   -0.1252129607
   O   8   -0.4700755743
   C   9    0.0721480027
   C  10    0.0721480027
   C  11    0.0028777228
   C  12   -0.0026882844
   C  13    0.0382807457
   C  14    0.2525323105
   C  15    0.0187546688
   C  16    0.0187546688


BOND ANGLES
  12   11   13  Car  Car  Car    120.206
  11   13    4  Car  Car  Car    119.913
  15   16   10   C3   C3   C3    108.141
  16   10    2   C3   C3   N3    107.366
  13   11   12  Car  Car  Car    120.206
  11   12    3  Car  Car  Car    119.502
  10   16   15   C3   C3   C3    108.141
  16   15    9   C3   C3   C3    108.060


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


CHIRAL ATOMS
   N     2 is chiral: counterclockwise