../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner O Si A2B_oP12_33_2a_a a b/a c/a x1 y1 z1 x2 y2 z2 x3 y3 z3 standard 1 5.097 1.3947224 1.0023936 0.9872638 0.45381962 0.29653077 0.84060886 0.79860566 0.45389665 0.95649465 0.37519346 0.99958257 Sim_LAMMPS_Buckingham_CarreHorbachIspas_2008_SiO__SM_886641404623_000