../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
C
A_hP12_194_bc2f
a c/a z3 z4
standard
1
2.4678 13.950077 0.86916696 0.13083843
Sim_LAMMPS_reaxFF_FthenakisPetsalakisTozzini_2022_CHON__SM_198543900691_000