../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
O
A_oC12_63_cg
a b/a c/a y1 x2 y2
standard
1
9.6235 0.39411856 0.73089832 0.81430905 0.38555224 0.48918155
Sim_LAMMPS_Buckingham_FangKeltyHe_2014_LaO__SM_576027677976_000