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=70.57269024302879 stress="-3.3368208302876905 0.005697492925715193 -0.01949124322845969 0.005697492925715193 -3.3690432341269667 -0.009929549145099146 -0.01949124322845969 -0.009929549145099146 -3.391199214338919" pbc="T T T" Cs -0.14459490 0.11115480 0.11044915 1.24809525 -1.39733375 -0.20658668 Cs 1.70960170 1.31143450 -0.16166483 -1.78487900 1.50469521 0.30309804 Cs 1.28829595 0.03769167 1.64041416 -0.69598189 -1.05523150 -0.50230565 Cs -0.22187219 1.51878885 1.32834452 1.23276564 0.94787004 0.40579429