../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner Al O A2B3_oP40_33_4a_6a a b/a c/a x1 y1 z1 x2 y2 z2 x3 y3 z3 x4 y4 z4 x5 y5 z5 x6 y6 z6 x7 y7 z7 x8 y8 z8 x9 y9 z9 x10 y10 z10 standard 1 4.8852 1.718599 1.8475395 0.18580639 0.8463828 0.65702946 0.32650992 0.030701775 0.36828859 0.32256152 0.3475339 0.56899053 0.31546298 0.66013996 0.37825664 0.47768196 0.82436666 0.49680587 0.52118114 0.51178569 0.50382021 0.15717832 0.16873177 0.24227731 0.15696299 0.49873703 0.27450837 0.98087873 0.3314869 0.50965875 0.15591305 0.83895803 0.26776427 Sim_LAMMPS_SMTBQ_SallesPolitanoAmzallag_2016_AlO__SM_853967355976_000