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=24.868551444763852 stress="-5.537774728435261 0.7634822884785201 -0.3113451872087178 0.7634822884785201 -3.9702573795928124 -0.13004175566158563 -0.3113451872087178 -0.13004175566158563 -3.5466978009719434" pbc="T F F" Au -0.06254558 0.09073906 0.27219963 -8.97184966 -40.03414630 -43.37374115 Au 1.43381326 1.63132919 0.25978669 8.40613377 27.04539964 -30.21956067 Au 1.22592512 0.18365717 1.70288723 30.79147434 -44.84650338 34.72524199 Au 0.08343331 1.29585403 1.44809454 -30.22575844 57.83525004 38.86805983