4 Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=645.6479992495191 stress="-307.7000758494981 -8.21359366907587 10.465406316892212 -8.21359366907587 -174.7205555716257 -5.195207553813513 10.465406316892212 -5.195207553813513 -327.5217886302015" pbc="T F T" C 0.03848316 0.19178619 0.17895518 290.06803804 -399.53707558 -223.71879308 C 1.04140871 0.86455359 0.03253581 -166.57095596 530.14916057 -84.14579947 C 0.89904689 0.10609294 0.71603997 -401.06148561 -607.15410152 91.90335547 C -0.19401975 0.57157598 0.76361598 277.56440353 476.54201653 215.96123708