../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
Al H
AB3_oC48_63_ad_cfgh
a b/a c/a y2 y4 z4 x5 y5 x6 y6 z6
standard
1
6.4616 1.6953386 1.0060976 0.051318834 0.71556475 0.56448639 0.29992095 0.20798316 0.69310352 0.60116324 0.94070871
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000