---------------------------------------------------------------------
        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]                            
---------------------------------------------------------------------
        0.0996805599       -0.2615057763        0.7592461230
        0.7513689938       -0.3997929546        0.0928973484
       -0.0274453311       -0.5146815246       -0.4617139872


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

   Component         Value                Principal Axis 
   HFS_11          -0.846690         0.4206   -0.5654   -0.7095
   HFS_22          -0.221354         0.0693    0.7998   -0.5962
   HFS_33           0.306217         0.9046    0.2016    0.3756
   HFS_iso         -0.253942


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

   Component         Value                Principal Axis 
   HFS_11           0.446971         0.5758   -0.4517    0.6815
   HFS_22           0.846467         0.4472   -0.5239   -0.7250
   HFS_33           0.974852         0.6845    0.7222   -0.0996
   HFS_iso          0.756097

---------------------------------------------------------------------
                             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 -----
        7.5857713461       -1.3064679481        0.4628157974
       -1.3244464933        6.3611793305        0.9280450102
        0.4604554739        0.9097878952        8.1022962865

 ----- G * HFS_ani --> PC -----
      -13.3040166496       -2.0178209634      -31.5528427287
      -32.2842840329        7.1863062339      -10.9746098807
       -8.6130739216        8.0444132593        8.5601351203

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

 ----- GT * HFS -----
       -5.7182453036        4.3433583671      -23.4505464422
      -24.6985126869       13.5474855644       -2.8723135942
       -1.0273025755       14.4055925899       16.6624314067

 ------- PNMR(mu,B) -------
       -5.7182453036        4.3433583671      -23.4505464422
      -24.6985126869       13.5474855644       -2.8723135942
       -1.0273025755       14.4055925899       16.6624314067
  
  The values of the principal components of PNMR-tensor
  
  Component          Value             Principal Axis 
---------------------------------------------------------------------
  SIGMA_11        -13.131225         0.9065    0.2769    0.3188
  SIGMA_22          9.143045         0.0177   -0.7792    0.6265
  SIGMA_33         28.479852        -0.4219    0.5622    0.7113
---------------------------------------------------------------------

 ISOTROPIC pNMR shielding contributions: 
 Orb =       0.0000
 FC  =       7.3497
 PC  =       0.8141
 SUM =       8.1639
  
 ***************************************************
 * Well, here we are. How does it look for you ??? *
 ***************************************************
