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=667089.1060724207 stress="-105005.1258046921 54277.45569041959 -17914.857228984176 54277.45569041959 -110969.21360663058 -17890.13841473972 -17914.857228984176 -17890.13841473972 -81956.88886827315" pbc="T F F" Ac 0.15839933 0.09073906 0.27219963 -342376.49794301 -1011000.15996730 -1304452.11629521 Ac 1.43381326 1.63132919 0.25978669 314137.55067063 268586.38478106 -386397.64407469 Ac 1.22592512 0.18365717 1.70288723 1783389.03470554 -1517441.14210166 862575.90897402 Ac 0.08343331 1.29585403 1.44809454 -1755150.08743316 2259854.91728790 828273.85139587