 nspin  vdif :::::: Potentials for spin-polarized non-relativistic Fe.          
    2   0.0000000000000D+00
 LSMS:           Fe     z= 26.    xvalws=  14.36478
  26.                      2.38649   10.  0.6683858370595D+00
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    7    0
    1    0   -1  -508.40828  1s   
    2    0   -1   -58.14754  2s   
    2    1    1   -50.01109  2p   
    2    1   -2   -50.01109  2p   
    3    0   -1    -5.71760  3s   
    3    1    1    -3.34373  3p   
    3    1   -2    -3.34373  3p   
 LSMS:           Fe     z= 26.    xvalws=  11.34731
  26.                      2.38649   10.  0.6683858370595D+00
                 -0.9130178265955D+01 0.8698217340445D+00 1001 1036
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    3    1   -2    -3.09770  3p   
