../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
Al Pt
AB2_oP12_62_c_2c
a b/a c/a x1 z1 x2 z2 x3 z3
standard
1
5.4437 0.74892077 1.4520455 0.30440816 0.39549436 0.95865506 0.7918827 0.83712741 0.43172681
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000