---------------------------------------------------------------------
        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]                            
---------------------------------------------------------------------
       -0.1415784911        0.0845757996       -0.0455018633
       -0.0843398088       -0.0847118099       -0.1210004371
        0.0853626658       -0.0224190898       -0.1059212319


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

   Component         Value                Principal Axis 
   HFS_11          -0.174936         0.4252   -0.5635   -0.7083
   HFS_22          -0.135859         0.8986    0.3565    0.2558
   HFS_33          -0.021417         0.1084   -0.7452    0.6580
   HFS_iso         -0.110737


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

   Component         Value                Principal Axis 
   HFS_11           0.084286         0.5168   -0.4861    0.7047
   HFS_22           0.174943         0.4212   -0.5722   -0.7037
   HFS_33           0.198740         0.7453    0.6605   -0.0910
   HFS_iso          0.152657

---------------------------------------------------------------------
                             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 -----
        3.3079462552       -0.5697147408        0.2018212406
       -0.5775546899        2.7739353567        0.4046949052
        0.2007919684        0.3967334795        3.5331885759

 ----- G * HFS_ani --> PC -----
        1.4449073854       -5.4579033610       -2.1324592235
       -1.0109600671       -0.6523319191        0.7907555140
       -5.7827720935       -1.3936945285       -0.2273017308

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

 ----- GT * HFS -----
        4.7528536406       -2.6839680042        1.4007293523
        2.2969861880        2.1216034376        4.3239440899
       -2.4748258384        1.3802408282        3.3058868451

 ------- PNMR(mu,B) -------
        4.7528536406       -2.6839680042        1.4007293523
        2.2969861880        2.1216034376        4.3239440899
       -2.4748258384        1.3802408282        3.3058868451
  
  The values of the principal components of PNMR-tensor
  
  Component          Value             Principal Axis 
---------------------------------------------------------------------
  SIGMA_11         -0.206435        -0.0384    0.7728   -0.6334
  SIGMA_22          4.502343         0.9012    0.3006    0.3121
  SIGMA_33          5.884435        -0.4316    0.5589    0.7081
---------------------------------------------------------------------

 ISOTROPIC pNMR shielding contributions: 
 Orb =       0.0000
 FC  =       3.2050
 PC  =       0.1884
 SUM =       3.3934
  
 ***************************************************
 * Well, here we are. How does it look for you ??? *
 ***************************************************
