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=-31.058978981137255 stress="0.00017186608931827433 7.302001177443405e-05 7.099622795928388e-05 7.302001177443405e-05 0.0001719370492747187 -3.661855858410212e-05 7.099622795928388e-05 -3.661855858410212e-05 0.00015155956266516091" pbc="F F F" Cu 20.85540510 21.11115480 21.11044915 0.97482590 0.85217036 0.86238414 Cu 22.70960170 22.31143450 22.33833517 -1.51007222 2.60238394 1.69690516 Cu 23.64028300 20.89839703 21.13492844 0.73768976 -1.12633738 -0.75630171 Cu 25.27812781 22.51878885 22.32834452 -0.82226118 0.40559865 0.78521414 Cu 20.87679405 23.95894820 21.20259391 0.81288343 -0.99535948 0.66791579 Cu 22.56504129 25.20865944 22.36550211 -2.98104473 2.33813024 2.77300699 Cu 23.78802619 24.22277084 21.18584377 2.85105255 -2.50918531 -2.17345190 Cu 25.68362810 25.69581920 22.64685009 -1.25045063 -1.17337600 0.65554501 Cu 21.26959405 21.17626233 23.85402479 0.80297426 0.77870965 -0.32025974 Cu 22.70996341 22.49207130 25.65300231 0.45979691 0.48634203 -1.33441246 Cu 24.03848316 20.95774659 23.91852158 -0.62916370 0.77457751 -0.28165120 Cu 25.45789336 22.38825682 25.27041603 -1.10084092 0.93543015 -0.78372414 Cu 21.19178619 24.17895518 24.29140871 0.87287555 -0.91214906 -0.70752311 Cu 22.61455359 25.53253581 25.64904689 0.80997013 -0.67809124 -0.51869939 Cu 23.78091226 24.10609294 23.96603997 0.85524489 -1.03379953 0.35635494 Cu 25.30598025 25.32157598 25.51361598 -0.88348001 -0.74504454 -0.92130253