../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
Cl Na O
ABC3_cP20_198_a_a_b
a x1 x2 x3 y3 z3
standard
2
6.6764 0.415405 0.069505219 0.30190567 0.59214229 0.49854846
7.2553 0.23507224 0.90904882 0.25620953 0.15956778 0.42780502
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000