../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
O Si
A2B_cI36_217_g_d
a x2 z2
standard
1
8.9828 0.14770987 0.51621582
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000