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=-3.3164549546210886 stress="-0.9069863460573112 0.034706826594841325 0.04839227431372724 0.034706826594841325 -1.3190108789108015 -0.021848591206473686 0.04839227431372724 -0.021848591206473686 -1.1879737560073236" free_energy=-3.3164549546210886 pbc="F T T" Cu 0.15720406 2.76564846 2.88507600 -8.61191882 4.62362043 8.37855977 Cu 1.79768454 1.69485422 2.86065667 8.79512174 -6.40936094 5.62141655 Cu 1.67089611 2.91979814 1.49814991 7.15609912 6.66616463 -6.42957251 Cu 0.26235339 1.34838096 1.71005355 -7.33930204 -4.88042411 -7.57040380