../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
Br F
AB3_oC16_36_a_3a
a b/a c/a y1 z1 y2 z2 y3 z3 y4 z4
standard
1
5.8949 1.3451458 1.0505013 0.84030844 0.75767489 0.737769 0.49831751 0.63408719 0.88485547 0.065199258 0.58915213
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003