---------------------------------------------------------------------
        Collecting the numbers for calculating of PNMR               
---------------------------------------------------------------------
 --- TEMPERATURE ----
     293.00000
 ------ GVALUE ------
       1.40482
 --- 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]                            
---------------------------------------------------------------------
       -0.1088040445        0.0323858933       -0.1091179050
        0.0211779190        0.0344028842        0.0309653304
       -0.1018398750        0.0358349430       -0.0467627012


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

   Component         Value                Principal Axis 
   HFS_11          -0.195229        -0.7828    0.1780   -0.5962
   HFS_22           0.025440        -0.5870   -0.5292    0.6127
   HFS_33           0.048625        -0.2065    0.8296    0.5188
   HFS_iso         -0.040388


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

   Component         Value                Principal Axis 
   HFS_11           0.025205         0.5582    0.5307   -0.6378
   HFS_22           0.048575        -0.2191    0.8357    0.5036
   HFS_33           0.195531         0.8002   -0.1414    0.5828
   HFS_iso          0.089770

---------------------------------------------------------------------
                             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 -----
        4.7970268067       -0.8261733030        0.2926715934
       -0.8375424255        4.0226295229        0.5868693622
        0.2911789917        0.5753240801        5.1236625399

 ----- G * HFS_ani --> PC -----
        9.5843236752       -7.9195659628        9.0370173789
       -6.8222253126       -7.4570329385       -9.7053276121
        8.3791349227       -9.0088781047        1.0259807367

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

 ----- GT * HFS -----
       14.3813504819       -3.8969364398       14.1606799188
       -2.0251985059       -3.4344034156       -4.5816650721
       13.1761617295       -4.9862485818        6.1496432766

 ------- PNMR(mu,B) -------
       14.3813504819       -3.8969364398       14.1606799188
       -2.0251985059       -3.4344034156       -4.5816650721
       13.1761617295       -4.9862485818        6.1496432766
  
  The values of the principal components of PNMR-tensor
  
  Component          Value             Principal Axis 
---------------------------------------------------------------------
  SIGMA_11         -6.245283         0.3032   -0.7277   -0.6152
  SIGMA_22         -2.148817         0.5444    0.6622   -0.5149
  SIGMA_33         25.490690         0.7821   -0.1788    0.5969
---------------------------------------------------------------------

 ISOTROPIC pNMR shielding contributions: 
 Orb =       0.0000
 FC  =       4.6478
 PC  =       1.0511
 SUM =       5.6989
  
 ***************************************************
 * Well, here we are. How does it look for you ??? *
 ***************************************************
