../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
Cl H O
AB5C2_mP32_14_e_5e_2e
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
7.1958 1.6879013 0.93842241 146.3641 0.032693616 0.67039333 0.87476066 0.42286251 0.89964008 0.26626314 0.38655197 0.84841446 0.47775237 0.70625843 0.80498563 0.6294418 0.1915338 0.016053929 0.89329428 0.21334186 0.89730901 0.80550157 0.55491019 0.86946591 0.52189095 0.28446661 0.94042815 0.9861721
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003