Mn GTH-PADE-q15 GTH-LDA-q15
    4    6    5
     0.36500000    2     6.74868332    -0.57656900
    3
     0.28075266    2     9.37953150     2.15929667
                                       -5.57528002
     0.25453567    2     0.37117568     1.78710271
                                       -4.22905690
     0.22142210    1   -12.11538453
