../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
Cl F
AB3_mP32_14_2e_6e
a b/a c/a beta x1 y1 z1 x2 y2 z2 x3 y3 z3 x4 y4 z4 x5 y5 z5 x6 y6 z6 x7 y7 z7 x8 y8 z8
standard
1
16.527 0.27864101 0.9660616 151.5305 0.3880282 0.99836384 0.26061872 0.77383685 0.40242903 0.69353711 0.19087194 0.89359378 0.066550978 0.36680105 0.25506557 0.16449655 0.4056596 0.71173765 0.35843066 0.89415674 0.48800096 0.7224931 0.86480358 0.67578592 0.83513801 0.67879102 0.11262006 0.54209872
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003