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=503196.0623851498 stress="-2462641.4839197095 -226603.9193045268 2241935.2579281824 -226603.9193045268 -667903.8834506748 587892.2506137828 2241935.2579281824 587892.2506137828 -2931174.072276059" pbc="F F F" Ac 0.27500470 -0.13833825 -0.09601473 -70234.59235962 -105266.91422005 -89621.44786930 Ac 1.28802619 1.68051743 0.18584377 2049998.61515569 590401.06332346 -2377060.75185411 Ac 1.60214968 0.15371257 1.53510691 281592.00835678 -280746.20753487 134647.08266833 Ac 0.26959405 1.44667836 1.35402479 -2261356.03115286 -204387.94156854 2332035.11705508