Y GTH-PBE-q11
    4    6    1
     0.47500000    2    12.16776904    -2.32855103
    3
     0.24674070    2    23.45027195    -8.32535748
                                       10.74799029
     0.29656397    2     5.97863401    -5.85234964
                                        6.92459348
     0.45045569    2     1.18749048    -1.31867331
                                        1.49523499
