K GTH-PBE-q9
    3    6
     0.40000000    2    -3.36355184    -1.08652975
    2
     0.30531772    2    17.85062321    -5.62264870
                                        7.25880826
     0.31648432    2     7.33378021    -2.46094505
                                        2.91182945
