../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
Cl O
AB2_oP24_61_c_2c
a b/a c/a x1 y1 z1 x2 y2 z2 x3 y3 z3
standard
1
5.6911 1.9208237 1.2473863 0.17104973 0.60893478 0.49084799 0.093089431 0.70628311 0.35935761 0.20684345 0.48461288 0.40496888
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000