../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
Ca Si
A14B19_hR66_167_b2cef_2ce2f
a c/a x2 x3 x4 x5 x6 x7 x8 y8 z8 x9 y9 z9 x10 y10 z10
standard
1
8.6627419 7.9219349 0.054730634 0.10995619 0.15297991 0.21906542 0.49912156 0.83386845 0.9427686 0.19090354 0.42750559 0.83180081 0.21519074 0.38051718 0.99060531 0.43970547 0.72942664
Sim_LAMMPS_Buckingham_FreitasSantosColaco_2015_SiCaOAl__SM_154093256665_000