../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
O Si
A2B_hP12_182_cg_f
a c/a z2 x3
standard
1
5.1119 1.6888046 0.43713398 0.4208352
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000