../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
Ca O Si
AB3C_oP20_62_c_cd_a
a b/a c/a x2 z2 x3 z3 x4 y4 z4
standard
1
5.1034 1.4086883 1.0036054 0.49895846 0.00095716699 0.00014735025 0.96273759 0.25169156 0.98083225 0.75171527
Sim_LAMMPS_Buckingham_FreitasSantosColaco_2015_SiCaOAl__SM_154093256665_000