../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
H O P
A3B4C_mP32_14_3e_4e_e
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
12.8269 0.37581957 0.93716331 152.7221 0.48773357 0.12943675 0.30807686 0.27492433 0.42737562 0.21588563 0.12717954 0.48957951 0.80085366 0.28168549 0.67776853 0.022341406 0.33073697 0.099208591 0.19704195 0.27714843 0.63041227 0.23165785 0.95103879 0.85850568 0.82805871 0.21231016 0.81083452 0.06613482
Sim_LAMMPS_ReaxFF_XiaoShiHao_2017_PHOC__SM_424780295507_000