../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
O
A_mC4_12_i
a b/a c/a beta x1 z1
standard
2
6.1332 0.61429596 0.89643253 135.4539 0.097219577 0.15969399
4.8144 0.81652958 0.98066218 141.8659 0.18473196 0.088770687
Sim_LAMMPS_Buckingham_WangShinShin_2019_CrO__SM_295921111679_000