16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-36.379602081370614 stress="0.00012308613617730647 -1.2457578104509807e-05 3.540897344915182e-05 -1.2457578104509807e-05 0.00011684118337543761 1.383800628698009e-05 3.540897344915182e-05 1.383800628698009e-05 0.00012488738589824583" free_energy=-36.379602081370614 pbc="F F F" Cu 21.08343331 20.79585403 20.94809454 0.70863813 0.61858183 0.80077647 Cu 22.72094491 22.73171545 22.68190327 -1.20070090 -1.57450744 -0.71415504 Cu 23.82183498 21.21219253 20.92485375 -0.36810581 0.62110322 0.63849030 Cu 25.62990665 22.29221642 22.78278197 -0.84264617 0.25728380 0.22800955 Cu 21.06210000 24.11816198 20.82702941 0.55580272 -0.37080991 0.53487736 Cu 22.57034430 25.42645838 22.27377885 -0.48660768 0.06799479 0.32160984 Cu 23.91561068 24.13744216 20.90480033 0.06340640 -0.57144954 -0.18478328 Cu 25.37719504 25.29869006 22.61041876 1.04136505 0.54775815 -0.89488478 Cu 20.76735611 20.83533445 23.74148635 0.74188047 0.83785416 -0.48297760 Cu 22.58611608 22.53369179 25.52598936 0.28088246 0.34416846 -0.89580497 Cu 23.96953747 20.96375436 24.04885945 -0.31974034 0.56552637 -0.18286247 Cu 25.25559716 22.20178472 25.79874826 -0.60712495 0.35636226 -0.61903505 Cu 20.77290972 23.73589080 23.97179518 0.77975268 -0.32344498 -0.09758591 Cu 22.55835534 25.24645637 25.48193431 0.43136916 -0.74823535 -0.43577310 Cu 23.92001865 24.20070203 23.70342959 -0.00291892 -0.08922768 2.69435239 Cu 25.40085166 25.49793547 25.78187239 -0.77525229 -0.53895814 -0.71025370