SMILES:c1(NC(=O)CNCC)c(cccc1C)C	

FORMULA: C12H18N2O
MASS: 206.2841
EXACT MASS: 206.1419132
INTERATOMIC DISTANCES

              C   1      N   2      C   3      C   4      C   5      O   6
              ------------------------------------------------------------------
   C   1    0.0000 
   N   2    0.8233     0.0000 
   C   3    1.4250     0.8212     0.0000 
   C   4    0.8333     1.4352     1.6529     0.0000 
   C   5    0.8269     1.4292     2.1803     1.4372     0.0000 
   O   6    1.6466     1.4280     0.8292     1.4250     2.4735     0.0000 
   N   7    2.8583     2.1828     1.4333     2.9808     3.5973     1.6600 
   C   8    2.1777     1.4250     0.8233     2.4762     2.8542     1.4316 
   C   9    1.6544     2.4777     2.9745     1.4292     1.4352     2.8542 
   C  10    1.4292     2.1826     2.8542     1.6502     0.8275     2.9687 
   C  11    1.4372     2.1892     2.4798     0.8269     1.6583     2.1826 
   C  12    1.4352     1.6583     1.4388     0.8233     2.1892     0.8275 
   C  13    1.4342     1.6574     2.4786     2.1940     0.8250     2.9793 
   C  14    3.5960     2.8583     2.1867     3.7860     4.2875     2.4833 
   C  15    4.2833     3.5931     2.8583     4.3660     5.0160     2.9785 

              N   7      C   8      C   9      C  10      C  11      C  12
              ------------------------------------------------------------------
   N   7    0.0000 
   C   8    0.8264     0.0000 
   C   9    4.3701     3.7794     0.0000 
   C  10    4.2876     3.5919     0.8250     0.0000 
   C  11    3.7900     3.3031     0.8233     1.4280     0.0000 
   C  12    2.4875     2.1896     2.1811     2.4735     1.4292     0.0000 
   C  13    3.7869     2.9779     2.1873     1.4311     2.4833     2.8694 
   C  14    0.8233     1.4333     5.1559     5.0187     4.6015     3.3108 
   C  15    1.4250     2.1835     5.7748     5.7125     5.1559     3.7860 

              C  13      C  14      C  15
              ---------------------------------
   C  13    0.0000 
   C  14    4.3720     0.0000 
   C  15    5.1559     0.8233     0.0000 



ATOMIC CHARGES
   C   1    0.0654408847
   N   2   -0.1786327752
   C   3    0.2632761168
   C   4   -0.0068191995
   C   5   -0.0068191995
   O   6   -0.2714147630
   N   7   -0.2085053100
   C   8    0.1756498962
   C   9   -0.0005615918
   C  10   -0.0029925225
   C  11   -0.0029925225
   C  12    0.0323800417
   C  13    0.0323800417
   C  14    0.0893138780
   C  15    0.0202970248


BOND ANGLES
   9   11    4  Car  Car  Car    120.009
  11    4    1  Car  Car  Car    119.923
   4   11    9  Car  Car  Car    120.009
  11    9   10  Car  Car  Car    120.069


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