../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
Se
A_hP3_152_a
a c/a x1
standard
1
4.5086 1.120503 0.78013909
Sim_LAMMPS_BOP_ZhouFosterVanSwol_2014_CdTeSe__SM_567065323363_000