../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner H Mg A2B_oP24_61_2c_c a b/a c/a x1 y1 z1 x2 y2 z2 x3 y3 z3 standard 1 4.7275 1.960973 1.0326811 0.16793656 0.7991738 0.38421068 0.51121093 0.97365317 0.74190157 0.27095201 0.88331291 0.030396216 Sim_LAMMPS_ADP_SmirnovaStarikovVlasova_2018_MgH__SM_899925688973_000