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=13.964874807900994 stress="-3.2616286471035054 -1.1787625884495716 -0.5152730003478581 -1.1787625884495716 -2.894931279435562 0.10518120514108488 -0.5152730003478581 0.10518120514108488 -2.2840670967513095" free_energy=13.964874807900994 pbc="T F F" Au 0.14904689 0.10609294 0.01361598 -15.41360551 -26.03184777 -16.15864606 Au 1.35198705 1.47567541 0.06329927 7.61918115 28.26465122 -19.57459455 Au 1.43745442 0.09073906 1.77219963 -6.16851718 -27.81916576 19.81870750 Au 2.65973838 1.63132919 1.75978669 13.96294153 25.58636230 15.91453312