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=-27.390857975228627 stress="0.00014532562426727865 6.663557317215827e-05 5.863124894543997e-05 6.663557317215827e-05 0.00015850937186953772 -2.9391280315849736e-05 5.863124894543997e-05 -2.9391280315849736e-05 0.00013918975018139897" pbc="F F F" Cu 20.85540510 21.11115480 21.11044915 0.86921891 0.72261860 0.74438483 Cu 22.70960170 22.31143450 22.33833517 -1.07023623 2.13129843 1.32079514 Cu 23.64028300 20.83509776 21.11608958 0.50693590 -0.68200316 -0.37363228 Cu 25.27812781 22.51878885 22.32834452 -0.76385929 0.37877089 0.59386227 Cu 20.87679405 23.95894820 21.20259391 0.72264692 -0.86296986 0.61513689 Cu 22.56504129 25.20865944 22.36550211 -2.88660452 2.37841979 2.55387991 Cu 23.78802619 24.22277084 21.18584377 2.71169938 -2.42856703 -1.99093574 Cu 25.68362810 25.69581920 22.64685009 -1.21249916 -1.13244797 0.54078150 Cu 21.26959405 21.17626233 23.91732405 0.62362345 0.65599552 -0.32719757 Cu 22.70996341 22.49207130 25.65300231 0.40767619 0.47426006 -1.13529452 Cu 24.03848316 20.95774659 23.91852158 -0.60406845 0.66155209 -0.33026861 Cu 25.45789336 22.38825682 25.27041603 -0.83609926 0.87526932 -0.64700777 Cu 21.19178619 24.17895518 24.29140871 0.67897595 -0.85525228 -0.77492109 Cu 22.61455359 25.53253581 25.64904689 0.74345407 -0.61162271 -0.50546906 Cu 23.78091226 24.10609294 23.90349439 0.82608733 -1.01320626 0.55481317 Cu 25.30598025 25.32157598 25.51361598 -0.71695117 -0.69211543 -0.83892705