---------------------------------------------------------------------
        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]                            
---------------------------------------------------------------------
       -0.0564188896       -0.0274468414        0.0912298799
        0.1395250408       -0.1247500665        0.0425693555
       -0.0391066347       -0.0578097955       -0.1524475958


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

   Component         Value                Principal Axis 
   HFS_11          -0.174951        -0.4273    0.5820    0.6919
   HFS_22          -0.136542         0.2364   -0.6667    0.7068
   HFS_33          -0.022123         0.8727    0.4656    0.1473
   HFS_iso         -0.111206


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

   Component         Value                Principal Axis 
   HFS_11           0.084300        -0.8895   -0.0882   -0.4482
   HFS_22           0.174873         0.4247   -0.5213   -0.7402
   HFS_33           0.198811        -0.1684   -0.8488    0.5012
   HFS_iso          0.152661

---------------------------------------------------------------------
                             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 -----
        3.3219365201       -0.5721242298        0.2026748012
       -0.5799973364        2.7856671345        0.4064064775
        0.2016411759        0.3984113806        3.5481314559

 ----- G * HFS_ani --> PC -----
       -1.9451597348       -2.7152378243       -6.2557879871
       -8.2176627655        0.9045967216       -4.7047345386
       -2.1788282809       -0.9925739853        1.5984145851

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

 ----- GT * HFS -----
        1.3767767853        0.0704293102       -2.7076565312
       -4.8957262454        3.6902638561       -1.1566030827
        1.1431082392        1.7930931492        5.1465460410

 ------- PNMR(mu,B) -------
        1.3767767853        0.0704293102       -2.7076565312
       -4.8957262454        3.6902638561       -1.1566030827
        1.1431082392        1.7930931492        5.1465460410
  
  The values of the principal components of PNMR-tensor
  
  Component          Value             Principal Axis 
---------------------------------------------------------------------
  SIGMA_11         -0.188312         0.8488    0.5203    0.0934
  SIGMA_22          4.517758         0.3109   -0.6343    0.7078
  SIGMA_33          5.884141        -0.4276    0.5718    0.7002
---------------------------------------------------------------------

 ISOTROPIC pNMR shielding contributions: 
 Orb =       0.0000
 FC  =       3.2186
 PC  =       0.1860
 SUM =       3.4045
  
 ***************************************************
 * Well, here we are. How does it look for you ??? *
 ***************************************************
