---------------------------------------------------------------------
        Collecting the numbers for calculating of PNMR               
---------------------------------------------------------------------
 --- TEMPERATURE ----
     293.00000
 ------ GVALUE ------
       5.58570
 --- MULTIPLICITY ---
      2
---------------------------------------------------------------------
                             GT(B,S)                                 
---------------------------------------------------------------------
        2.2217343298       -0.3879062666        0.1348590258
       -0.3826406780        1.8630736219        0.2664603120
        0.1355503216        0.2718074886        2.3730150816


   Component         Value                Principal Axis 
    GT_11           1.512946         0.4982    0.8024   -0.3287
    GT_22           2.443049         0.7629   -0.2254    0.6059
    GT_33           2.501836        -0.4121    0.5526    0.7244
    GT_iso          2.152610

---------------------------------------------------------------------
                           HFS(I,S) [MHz]                            
---------------------------------------------------------------------
       -0.2488385267       -0.0159488320        0.0171508201
       -0.0168676896       -0.2842342845        0.0047321635
        0.0181913261        0.0063045235       -0.2550100891


               Symmetrized by prescription: (A+A^T)/2
               --------------------------------------

   Component         Value                Principal Axis 
   HFS_11          -0.294460        -0.4257   -0.8502    0.3096
   HFS_22          -0.261394        -0.4275    0.4906    0.7593
   HFS_33          -0.232229         0.7975   -0.1909    0.5724
   HFS_iso         -0.262694


                Symmetrized by prescription:  A*A^T
                -----------------------------------

   Component         Value                Principal Axis 
   HFS_11           0.232230        -0.7982    0.1893   -0.5718
   HFS_22           0.261395         0.4272   -0.4913   -0.7590
   HFS_33           0.294462        -0.4247   -0.8502    0.3113
   HFS_iso          0.262696

---------------------------------------------------------------------
                             CS(mu,B)                                
---------------------------------------------------------------------
        0.0000000000        0.0000000000        0.0000000000
        0.0000000000        0.0000000000        0.0000000000
        0.0000000000        0.0000000000        0.0000000000


 Component           Value                Principal Axis 
 SIGMA_11           0.000000         1.0000    0.0000    0.0000
 SIGMA_22           0.000000         0.0000    1.0000    0.0000
 SIGMA_33           0.000000         0.0000    0.0000    1.0000
 SIGMA_iso          0.000000

---------------------------------------------------------------------
                           Final results                             
---------------------------------------------------------------------

 ----- G * HFS_iso --> FC -----
        7.8472166697       -1.3514956611        0.4787668485
       -1.3700938410        6.5804188136        0.9600302911
        0.4763251758        0.9411439406        8.3815437588

 ----- G * HFS_ani --> PC -----
       -0.5281805499       -7.5225617734       -8.4169588787
       -8.8343613321        0.4358368729       -7.4630374267
       -7.8953553733       -5.7311415612       -0.3013673617

 ----- CS_orb -----
        0.0000000000        0.0000000000        0.0000000000
        0.0000000000        0.0000000000        0.0000000000
        0.0000000000        0.0000000000        0.0000000000

 ----- GT * HFS -----
        7.3190361197       -0.9421429598       -0.0354151199
       -0.9871446624        7.0162556865        0.9185063321
       -0.0481387037        0.8492772523        8.0801763971

 ------- PNMR(mu,B) -------
        7.3190361197       -0.9421429598       -0.0354151199
       -0.9871446624        7.0162556865        0.9185063321
       -0.0481387037        0.8492772523        8.0801763971
  
  The values of the principal components of PNMR-tensor
  
  Component          Value             Principal Axis 
---------------------------------------------------------------------
  SIGMA_11          5.976403        -0.5473   -0.7754    0.3149
  SIGMA_22          7.639166        -0.7397    0.2721   -0.6155
  SIGMA_33          8.799900        -0.3916    0.5698    0.7225
---------------------------------------------------------------------

 ISOTROPIC pNMR shielding contributions: 
 Orb =       0.0000
 FC  =       7.6031
 PC  =      -0.1312
 SUM =       7.4718
  
 ***************************************************
 * Well, here we are. How does it look for you ??? *
 ***************************************************
