---------------------------------------------------------------------
        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]                            
---------------------------------------------------------------------
       -0.2484268566       -0.0152493289        0.0170622710
       -0.0159895185       -0.2830165033        0.0045715064
        0.0184287140        0.0068139899       -0.2528883699


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

   Component         Value                Principal Axis 
   HFS_11          -0.292842        -0.4231   -0.8517    0.3093
   HFS_22          -0.260093        -0.4585    0.4956    0.7377
   HFS_33          -0.231396         0.7815   -0.1703    0.6002
   HFS_iso         -0.261444


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

   Component         Value                Principal Axis 
   HFS_11           0.231398        -0.7825    0.1685   -0.5995
   HFS_22           0.260095         0.4579   -0.4968   -0.7373
   HFS_33           0.292846        -0.4220   -0.8514    0.3116
   HFS_iso          0.261446

---------------------------------------------------------------------
                             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 -----
        7.8098649549       -1.3450627203        0.4764879815
       -1.3635723753        6.5490968893        0.9554606738
        0.4740579309        0.9366642198        8.3416487177

 ----- G * HFS_ani --> PC -----
       -0.4993174146       -7.5063270267       -8.3775452337
       -8.8165996859        0.4417472659       -7.4240673830
       -7.8662849414       -5.7189617224       -0.3314625676

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

 ----- GT * HFS -----
        7.3105475404       -0.9572301374       -0.0358965160
       -1.0067347310        6.9908441551        0.9175813347
       -0.0564199864        0.8301351669        8.0101861501

 ------- PNMR(mu,B) -------
        7.3105475404       -0.9572301374       -0.0358965160
       -1.0067347310        6.9908441551        0.9175813347
       -0.0564199864        0.8301351669        8.0101861501
  
  The values of the principal components of PNMR-tensor
  
  Component          Value             Principal Axis 
---------------------------------------------------------------------
  SIGMA_11          5.943330        -0.5465   -0.7757    0.3158
  SIGMA_22          7.611303        -0.7274    0.2528   -0.6379
  SIGMA_33          8.756945        -0.4150    0.5783    0.7024
---------------------------------------------------------------------

 ISOTROPIC pNMR shielding contributions: 
 Orb =       0.0000
 FC  =       7.5669
 PC  =      -0.1297
 SUM =       7.4372
  
 ***************************************************
 * Well, here we are. How does it look for you ??? *
 ***************************************************
