../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
C
A_hP4_194_f
a c/a z1
standard
1
2.5124 1.6642254 0.062750617
Sim_LAMMPS_reaxFF_FthenakisPetsalakisTozzini_2022_CHON__SM_198543900691_000