4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=113785.5869195594 stress="-486503.7024644668 33076.90164736937 -3468.0495310696424 33076.90164736937 -486065.4126132751 -129589.28363037968 -3468.0495310696424 -129589.28363037968 -398801.8060189224" pbc="F F F" Cs 0.27196904 0.13725387 -0.09868480 -117118.60142565 -258184.56524956 -182656.16071148 Cs 1.71892853 1.44124316 -0.10689723 167141.87647403 121392.76597402 -72031.36486875 Cs 1.66921400 0.25558633 1.76929513 165280.81789054 -136903.99752206 84822.42073569 Cs 0.20825270 1.39401680 1.31280978 -215304.09293893 273695.79679760 169865.10484454