../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
O Si
A2B_mC24_9_4a_2a
a b/a c/a beta x1 y1 z1 x2 y2 z2 x3 y3 z3 x4 y4 z4 x5 y5 z5 x6 y6 z6
standard
2
5.1211 1.7197282 1.9200953 119.7874 0.031127296 0.99744614 0.74692678 0.34507853 0.78535409 0.69796531 0.021156438 0.5721936 0.73529443 0.5652744 0.91739365 0.9765003 0.36562971 0.94249584 0.78947561 0.24063363 0.60867634 0.66383756
7.0204 1.1832517 0.78116632 80.437 0.79016312 0.94571931 0.035015111 0.10649341 0.98749001 0.22650415 0.47760492 0.036017221 0.87071745 0.47399597 0.25646486 0.53239051 0.4925266 0.45078718 0.50664205 0.55435599 0.077464563 0.57920073
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000