../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
O Si
A2B_cI48_206_ad_c
a x2 x3
standard
1
8.5832 0.60767507 0.17528056
Sim_LAMMPS_Buckingham_FreitasSantosColaco_2015_SiCaOAl__SM_154093256665_000