SMILES:c1(ccc2c(c1)C(CC2)N)OC.Cl	ChemMol.com

FORMULA: C10H14ClNO
MASS: 199.6773
EXACT MASS: 199.0763918
INTERATOMIC DISTANCES

              C   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.8273     0.0000 
   C   3    1.4309     0.8255     0.0000 
   C   4    0.8229     1.4305     1.6530     0.0000 
   C   5    1.4273     1.6525     1.4341     0.8241     0.0000 
   C   6    1.6516     1.4332     0.8309     1.4302     0.8265     0.0000 
   C   7    2.4656     2.2343     1.5151     2.1172     1.3373     0.8265 
   C   8    2.7313     2.7358     2.1573     2.1500     1.3373     1.3373 
   C   9    2.2275     2.4672     2.1227     1.5073     0.8264     1.3372 
   N  10    2.7967     3.1841     2.9276     1.9897     1.5420     2.1607 
   H  11    2.1688     1.8191     2.4831     2.9893     3.4353     3.2304 
  Cl  12    1.5700     1.0354     1.6582     2.3499     2.6846     2.4153 
   O  13    0.8314     1.4365     2.1907     1.4313     2.1861     2.4830 
   C  14    1.6627     2.1965     2.9888     2.1914     2.9838     3.3143 

              C   7      C   8      C   9      N  10      H  11     Cl  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    0.8265     0.0000 
   C   9    1.3372     0.8264     0.0000 
   N  10    2.0951     1.3879     0.8265     0.0000 
   H  11    3.9931     4.5514     4.2607     4.9251     0.0000 
  Cl  12    3.1692     3.7442     3.5022     4.2069     0.8250     0.0000 
   O  13    3.2953     3.5175     2.9352     3.3853     1.9734     1.6860 
   C  14    4.1255     4.3207     3.6948     4.0597     2.1135     2.1452 

              O  13      C  14
              ----------------------
   O  13    0.0000 
   C  14    0.8313     0.0000 



ATOMIC CHARGES
   C   1    0.1384438091
   C   2    0.0365586623
   C   3   -0.0014204268
   C   4    0.0337140330
   C   5   -0.0058617006
   C   6   -0.0245380995
   C   7    0.0279139183
   C   8    0.0281660672
   C   9    0.1141124186
   N  10   -0.1281181254
   H  11    0.1453996612
  Cl  12   -0.1453996612
   O  13   -0.4714369370
   C  14    0.2524663807


BOND ANGLES
  13    1    2   O3  Car  Car    120.005
   1    2    3  Car  Car  Car    119.936
   6    5    4  Car  Car  Car    120.096
   5    4    1  Car  Car  Car    120.129
  10    9    5   N3   C3  Car    137.776
   9    5    4   C3  Car  Car    131.907
   9    5    6   C3  Car  Car    107.997
   5    9   10  Car   C3   N3    137.776
   2    1   13  Car  Car   O3    120.005
   1   13   14  Car   O3   C3    179.974
   4    5    6  Car  Car  Car    120.096
   5    6    7  Car  Car   C3    107.998


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


CHIRAL ATOMS
   C     9 is chiral: counterclockwise