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=744.84137869617 stress="-4597.78073495002 202.78321848999497 -1883.9413149923848 202.78321848999497 -1868.0630763181423 263.24028856574046 -1883.9413149923848 263.24028856574046 -3133.8900106396204" pbc="F F F" Na 0.01512430 -0.03748667 0.19682049 -2560.68391302 -337.48683869 -1870.84647947 Na 1.58572081 1.51514363 -0.04209208 695.97748419 533.83808747 -641.48844144 Na 1.56440269 -0.28162192 1.33569686 2273.84913387 -686.09110177 1847.29091794 Na 0.05947164 1.74246009 1.51522104 -409.14270504 489.73985299 665.04400297