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:Z:I:1:forces:R:3 energy=-7.524199190475143 pbc="T F T" Cu 0.21219253 -0.07514625 0.12990665 29 -2.58012962 -4.59599868 -2.66987013 Cu 1.28220450 1.78278197 0.06210000 29 7.11419146 4.21537710 -4.20351542 Cu 1.63362859 -0.17297059 1.57034430 29 1.50439378 -2.82253686 1.52729986 Cu 0.04852473 1.55473499 1.41561068 29 -6.03845562 3.20315844 5.34608569