/disk2/worker/repository/td/SurfaceTest__TD_955413365818_002/runner 
/disk2/worker/repository/td/SurfaceTest__TD_955413365818_002/runner
Ca
fcc
Pair_Morse_Shifted_GirifalcoWeizer_MedCutoff_Ca__MO_562200212426_001
5.572151304780001e-10