../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
Al Au
AB2_oP30_58_a2g_5g
a b/a c/a x2 y2 x3 y3 x4 y4 x5 y5 x6 y6 x7 y7 x8 y8
standard
1
8.9913 1.8970894 0.3631288 0.023846623 0.798467 0.97434103 0.59885859 0.65603669 0.98671067 0.64366653 0.81308352 0.67610354 0.59663361 0.63376239 0.39468933 0.66476989 0.21309401
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000