../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
Cr O
AB3_oC32_40_c_3c
a b/a c/a x1 y1 z1 x2 y2 z2 x3 y3 z3 x4 y4 z4
standard
1
8.6944 1.583663 0.61261272 0.55495897 0.4040033 0.81533353 0.82914666 0.35568745 0.080965806 0.94820109 0.34123828 0.56539669 0.12096902 0.47564154 0.78830397
Sim_LAMMPS_Buckingham_WangShinShin_2019_CrO__SM_295921111679_000