---------------------------------------------------------------------
        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]                            
---------------------------------------------------------------------
       -0.1415295268        0.0847236388       -0.0455234947
       -0.0846972884       -0.0845445176       -0.1209305197
        0.0853893762       -0.0225729644       -0.1061830932


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

   Component         Value                Principal Axis 
   HFS_11          -0.174991         0.4231   -0.5632   -0.7098
   HFS_22          -0.135889         0.8995    0.3552    0.2543
   HFS_33          -0.021378         0.1089   -0.7461    0.6569
   HFS_iso         -0.110752


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

   Component         Value                Principal Axis 
   HFS_11           0.084373         0.5178   -0.4872    0.7032
   HFS_22           0.174998         0.4204   -0.5709   -0.7052
   HFS_33           0.198895         0.7451    0.6608   -0.0908
   HFS_iso          0.152755

---------------------------------------------------------------------
                             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 -----
        3.3084003571       -0.5697929490        0.2018489458
       -0.5776339744        2.7743161517        0.4047504602
        0.2008195324        0.3967879415        3.5336735982

 ----- G * HFS_ani --> PC -----
        1.4438009042       -5.4616580798       -2.1328835977
       -0.9999897773       -0.6589929717        0.7880798388
       -5.7843518149       -1.3891452300       -0.2189181245

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

 ----- GT * HFS -----
        4.7522012613       -2.6873419280        1.4007900005
        2.3084105798        2.1153231800        4.3217534370
       -2.4759514578        1.3851709218        3.3147554736

 ------- PNMR(mu,B) -------
        4.7522012613       -2.6873419280        1.4007900005
        2.3084105798        2.1153231800        4.3217534370
       -2.4759514578        1.3851709218        3.3147554736
  
  The values of the principal components of PNMR-tensor
  
  Component          Value             Principal Axis 
---------------------------------------------------------------------
  SIGMA_11         -0.208245        -0.0390    0.7736   -0.6325
  SIGMA_22          4.504242         0.9022    0.2994    0.3106
  SIGMA_33          5.886283        -0.4297    0.5585    0.7096
---------------------------------------------------------------------

 ISOTROPIC pNMR shielding contributions: 
 Orb =       0.0000
 FC  =       3.2055
 PC  =       0.1886
 SUM =       3.3941
  
 ***************************************************
 * Well, here we are. How does it look for you ??? *
 ***************************************************
