../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner O Si A2B_oP48_55_gh3i_2i a b/a c/a x1 y1 x2 y2 x3 y3 z3 x4 y4 z4 x5 y5 z5 x6 y6 z6 x7 y7 z7 standard 1 9.8898 1.0021841 0.85641772 0.35075085 0.34814755 0.14964383 0.14740738 0.69286756 0.8068333 0.25114204 0.95903906 0.81776696 0.21733479 0.68330794 0.54098269 0.28159749 0.8299476 0.8793806 0.31267557 0.62125104 0.67023085 0.1873587 Sim_LAMMPS_Vashishta_VashishtaKaliaRino_1990_SiO__SM_887826436433_000