../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
C Mn
A2B5_mC28_15_f_e2f
a b/a c/a beta y1 x2 y2 z2 x3 y3 z3 x4 y4 z4
standard
1
13.1364 0.38645291 0.43065832 82.0997 0.57007131 0.60406666 0.20169591 0.91946535 0.60110275 0.43058485 0.60171177 0.70725584 0.92922851 0.67884298
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003