Mn GTH-PBE-q15
    4    6    5
     0.36500000    2     6.09304649    -0.44646948
    3
     0.29568592    2     1.88711984     6.35683658
                                       -8.20664074
     0.24561261    2    -6.57002452     7.98335983
                                       -9.44603874
     0.22252279    1   -11.61205092
