---------------------------------------------------------------------
        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]                            
---------------------------------------------------------------------
        0.0384645732        0.0358503144       -0.0654593346
        0.0427497909        0.1364093843        0.0081203412
       -0.0704462800        0.0046790553        0.0579248883


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

   Component         Value                Principal Axis 
   HFS_11          -0.027585         0.7586   -0.2059    0.6182
   HFS_22           0.105823         0.4813   -0.4626   -0.7446
   HFS_33           0.154561         0.4393    0.8623   -0.2518
   HFS_iso          0.077600


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

   Component         Value                Principal Axis 
   HFS_11           0.027418        -0.7770    0.1780   -0.6039
   HFS_22           0.105826         0.4765   -0.4607   -0.7488
   HFS_33           0.154724        -0.4115   -0.8695    0.2731
   HFS_iso          0.095990

---------------------------------------------------------------------
                             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 -----
       -2.3180594107        0.3992303727       -0.1414272149
        0.4047242551       -1.9438486790       -0.2835919211
       -0.1407059475       -0.2780129134       -2.4758990613

 ----- G * HFS_ani --> PC -----
        1.4747155852        1.4782172458        4.3633299150
        1.7377607998       -1.2823238397        1.6403829553
        4.3418067275        1.2566862896        0.7390335214

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

 ----- GT * HFS -----
       -0.8433438255       -0.4656314332        1.8874308537
       -0.5802986109       -3.2261725187       -0.8355161060
        2.0237473168       -0.6871623893       -1.7368655399

 ------- PNMR(mu,B) -------
       -0.8433438255       -0.4656314332        1.8874308537
       -0.5802986109       -3.2261725187       -0.8355161060
        2.0237473168       -0.6871623893       -1.7368655399
  
  The values of the principal components of PNMR-tensor
  
  Component          Value             Principal Axis 
---------------------------------------------------------------------
  SIGMA_11         -3.625836         0.2677   -0.7651   -0.5856
  SIGMA_22         -3.086138         0.5973    0.6087   -0.5222
  SIGMA_33          0.905593         0.7560   -0.2099    0.6200
---------------------------------------------------------------------

 ISOTROPIC pNMR shielding contributions: 
 Orb =       0.0000
 FC  =      -2.2459
 PC  =       0.3105
 SUM =      -1.9355
  
 ***************************************************
 * Well, here we are. How does it look for you ??? *
 ***************************************************
