---------------------------------------------------------------------
        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]                            
---------------------------------------------------------------------
       -0.0014209496       -0.0834603865        0.1464106498
        0.2486761161        0.1038855366       -0.0439252903
       -0.1130110438       -0.2441866368       -0.0169701920


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

   Component         Value                Principal Axis 
   HFS_11          -0.140428        -0.4197    0.5621    0.7127
   HFS_22           0.009153        -0.8648   -0.0092   -0.5020
   HFS_33           0.216769        -0.2756   -0.8270    0.4900
   HFS_iso          0.028498


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

   Component         Value                Principal Axis 
   HFS_11           0.140283        -0.5055    0.5195    0.6889
   HFS_22           0.155530        -0.8334   -0.5007   -0.2340
   HFS_33           0.363019         0.2233   -0.6924    0.6860
   HFS_iso          0.219611

---------------------------------------------------------------------
                             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 -----
       -3.3848286078        0.5829558899       -0.2065119129
        0.5909780529       -2.8384063789       -0.4141007099
       -0.2054587186       -0.4059542470       -3.6153059469

 ----- G * HFS_ani --> PC -----
        0.7672910363        9.0363606680      -13.7354751632
      -23.6803535899       -1.7959502376        5.8761456790
       11.8661124906       25.0893238375       10.1353271440

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

 ----- GT * HFS -----
       -2.6175375716        6.1979542891      -17.3507811101
      -27.0651821978       -4.6343566165        2.2608397321
        8.4812838827       22.2509174586        6.5200211971

 ------- PNMR(mu,B) -------
       -2.6175375716        6.1979542891      -17.3507811101
      -27.0651821978       -4.6343566165        2.2608397321
        8.4812838827       22.2509174586        6.5200211971
  
  The values of the principal components of PNMR-tensor
  
  Component          Value             Principal Axis 
---------------------------------------------------------------------
  SIGMA_11        -16.283068         0.5022    0.7987   -0.3316
  SIGMA_22         -3.230060         0.7553   -0.2183    0.6180
  SIGMA_33         18.781255        -0.4212    0.5608    0.7129
---------------------------------------------------------------------

 ISOTROPIC pNMR shielding contributions: 
 Orb =       0.0000
 FC  =      -3.2795
 PC  =       3.0356
 SUM =      -0.2440
  
 ***************************************************
 * Well, here we are. How does it look for you ??? *
 ***************************************************
