../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
C N
A3B4_cF56_227_ad_e
a x3
standard
1
6.7818 0.74413816
Sim_LAMMPS_reaxFF_FthenakisPetsalakisTozzini_2022_CHON__SM_198543900691_000