../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
Fe N
A2B_oP12_29_2a_a
a b/a c/a x1 y1 z1 x2 y2 z2 x3 y3 z3
standard
1
5.7186 0.85416011 0.9109922 0.62745939 0.99469621 0.99680394 0.60486893 0.51290295 0.33505277 0.38746236 0.24410437 0.16814329
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003