Sn GTH-PADE-q4 GTH-LDA-q4
    2    2
     0.60500000    1     4.61091234
    3
     0.66354369    3     1.64879146     0.05498623    -0.14066273
                                       -0.14197384     0.36318961
                                                      -0.57654563
     0.74586492    2     0.76935544     0.18807652
                                       -0.44507028
     0.94445897    1     0.22511508
