H GTH-PBE-q1 GTH-PBE
    1
     0.20000000    2    -4.17890044     0.72446331
    0
B GTH-PBE-q3 GTH-PBE
    2    1
     0.41899145    2    -5.85946171     0.90375643
    2
     0.37132046    1     6.29728018
     0.36456308    0
#
C GTH-PBE-q4 GTH-PBE
    2    2
     0.33847124    2    -8.80367398     1.33921085
    2
     0.30257575    1     9.62248665
     0.29150694    0
