Tc GTH-PBE-q15
    3    6    6
     0.43000000    2    27.30199947    -4.64715709
    3
     0.34617499    2    -0.37921852     3.34056578
                                       -4.31265188
     0.42346840    2    -0.24151639    -0.82215042
                                        0.97278149
     0.43186468    2     1.21878473    -2.67400954
                                        3.03204182
