../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
H
A_hP2_194_c
a c/a
standard
4
4.651 0.79916147
3.302 1.6282556
3.446 1.6268717
3.5577 1.6337803
Sim_LAMMPS_reaxFF_FthenakisPetsalakisTozzini_2022_CHON__SM_198543900691_000