ASFIT version 4.IV.2002
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 benzaldehyde 13C5                                            
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 Fit of Watson's Hamiltonian --> reduction-A, representation-I.r  :


 A    =      5176.4943317044071591226   +-    0.0112671926003601111
 B    =      1549.0466484653261431959   +-    0.0001718822873055997
 C    =      1192.5832027492101587995   +-    0.0001457726349368485
  DJ  =         0.0000685701487841455
  DJK =         0.0001627325265853607
  DK  =         0.0007393234520951088
  dJ  =         0.0000179628806891309
  dK  =         0.0002893787521218110

          Deviation of fit =       0.001165
 Weighted deviation of fit =       0.582471

-------------------------------------------------------------------------------
                 TRANSITION              Observed      Obs-Calc    Error
-------------------------------------------------------------------------------
!
!  IFPAN FTMW
!
! a-dipole transitions
!
   1.     4   1   4     3   1   3      10206.7155       -0.0002   0.0020         
   2.     4   0   4     3   0   3      10723.5845        0.0018   0.0020         
   3.     4   2   2     3   2   1      11189.9086       -0.0001   0.0020         

   4.     5   1   5     4   1   4      12718.5137        0.0000   0.0020         
   5.     5   0   5     4   0   4      13241.4216       -0.0009   0.0020         
   6.     5   1   4     4   1   3      14477.9552       -0.0002   0.0020         
-------------------------------------------------------------------------------

 Sigma   =       0.001165                               6 Transitions in fit
 Sigma.w =       0.582471                               3 Degrees of freedom

 A    /MHz        5176.494(11)           LJK /mHz           0.0               
 B    /MHz        1549.04664(17)         LKKJ/mHz           0.0               
 C    /MHz        1192.58320(14)         LK  /mHz           0.0               
  DJ  /kHz           0.0685701487841456  lJ  /mHz           0.0               
  DJK /kHz           0.1627325265853609  lJK /mHz           0.0               
  DK  /kHz           0.7393234520951095  lKJ /mHz           0.0               
  dJ  /kHz           0.0179628806891309  lK  /mHz           0.0               
  dK  /kHz           0.2893787521218112 PJ   /microHz       0.0               
 HJ   / Hz           0.0                PJJK /microHz       0.0               
 HJK  / Hz           0.0                PJK  /microHz       0.0               
 HKJ  / Hz           0.0                PKJ  /microHz       0.0               
 HK   / Hz           0.0                PKKJ /microHz       0.0               
 hJ   / Hz           0.0                PK   /microHz       0.0               
 hJK  / Hz           0.0                pJ   /microHz       0.0               
 hK   / Hz           0.0                pJJK /microHz       0.0               
  LJ  /mHz           0.0                pJK  /microHz       0.0               
  LJJK/mHz           0.0                pKKJ /microHz       0.0               
                                        pK   /microHz       0.0               

 CORRELATION COEFFICIENTS, C.ij:

          A        B        C    

 A        1.0000
 B        0.2398   1.0000
 C       -0.6325  -0.6717   1.0000

 Mean value of |C.ij|, i.ne.j =   0.5147
 Mean value of  C.ij,  i.ne.j =  -0.3548

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 MOST INFLUENTIAL TRANSITIONS:
                                         Observed      Obs-Calc      hjj >0.500

   6.     5   1   4     4   1   3      14477.9552       -0.0002   0.7260
   3.     4   2   2     3   2   1      11189.9086       -0.0001   0.6782
   5.     5   0   5     4   0   4      13241.4216       -0.0009   0.5726

                                             mean of all values = 0.5000

 WORST FITTING LINES (line number=(o-c)/error):
     2=  0.9    5= -0.5    6= -0.1    1= -0.1    3=  0.0    4=  0.0
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