../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
C N
A5B4_hR18_161_2ab_ab
a c/a x1 x2 x3 x4 y4 z4 x5 y5 z5
standard
1
9.1450262 1.2832553 9.498492e-06 0.87349379 0.77456675 0.066555552 0.87798688 0.18182198 0.11899671 0.78066418 0.32230466
Sim_LAMMPS_reaxFF_FthenakisPetsalakisTozzini_2022_CHON__SM_198543900691_000