../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
O Si
A2B_tP36_92_3b_ab
a c/a x1 x2 y2 z2 x3 y3 z3 x4 y4 z4 x5 y5 z5
standard
1
9.8049 0.98682292 0.29165881 0.47111002 0.9864849 0.27185857 0.23816979 0.92545676 0.14980005 0.29589841 0.17607592 0.12307408 0.3716088 0.028223423 0.14453316
Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000