W GTH-PBE-q6
    2    0    4
     0.71900000    1    10.69989013
    3
     0.46755372    2     5.80350289    -2.07063257
                                        2.67317516
     0.72666463    2     1.78871915    -2.55415819
                                        3.02212073
     0.49929065    2   -10.59832562     6.44789319
                                       -7.31122365
