../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
Ca Si
AB2_tI12_141_a_e
a c/a z2
standard
1
4.2876 3.153769 0.46019257
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000