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=-3.878800980742689 stress="-0.5763278890914256 -0.08098023343752074 0.06565483317036439 -0.08098023343752074 -0.7547437234811993 0.02843915140233793 0.06565483317036439 0.02843915140233793 -0.6978533964506286" free_energy=-3.878800980742689 pbc="F T T" Cu 0.22094491 0.30205975 0.18190327 -5.72575328 -0.69481369 -1.53660203 Cu 1.32183498 1.71219253 2.92485375 5.84898683 -2.69953304 2.02679380 Cu 1.62990665 2.78220450 1.78278197 5.80568252 3.63407711 -2.60352401 Cu 0.06210000 1.68215332 1.32702941 -5.92891607 -0.23973038 2.11333223