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=10.118904572415444 stress="-2.5074235278990615 0.09223697624233619 -0.04706854516717044 0.09223697624233619 -2.1466191058488073 0.5322976885473496 -0.04706854516717044 0.5322976885473496 -2.0477458899692684" pbc="T F F" Cu 0.08343331 0.22094491 0.23171545 -14.55602114 -15.60109949 -19.99800412 Cu 1.50893269 1.32183498 0.21219253 10.08026375 33.27087082 -27.42149231 Cu 1.42485375 0.12990665 1.28220450 13.67856190 -31.44062120 33.36203749 Cu 0.28278197 1.56210000 1.63362859 -9.20280451 13.77084987 14.05745893