Pa GTH-PBE-q31
    6   12   11    2
     0.24250000    2   150.19882800   -11.12938771
    4
     0.18605205    3     5.07903486    22.40141671   -15.44204321
                                      -54.03658977    39.87118412
                                                     -31.64677130
     0.20027122    3     2.86840165     4.15031405    -5.05059781
                                      -13.31919290    11.95189583
                                                      -8.49427586
     0.54434590    2     0.77426912    -0.49954660
                                        0.56643260
     0.26125191    1    -0.11570212
