../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
O Si
A2B_hP72_180_4k_gik
a c/a x1 x2 x3 y3 z3 x4 y4 z4 x5 y5 z5 x6 y6 z6 x7 y7 z7
standard
1
17.3663 0.74930757 0.62019243 0.56290899 0.59519098 0.065450774 0.065991815 0.53834361 0.18145292 0.081814942 0.63779502 0.93361528 0.073738267 0.43168731 0.1780454 0.24295717 0.43977424 0.1636624 0.11714026
Sim_LAMMPS_ReaxFF_BrugnoliMiyataniAkaji_SiCeNaClHO_2023__SM_282799919035_000