Se GTH-PBE-q6
    2    4
     0.51000000    0
    3
     0.43246005    3     6.51810990    -0.22271639    -1.19612899
                                       -1.65797833     3.08839178
                                                      -2.45133498
     0.47049162    2     2.28126223     0.36533529
                                       -0.43227055
     0.62560034    1     0.43979948
