32 Lattice="50.59012985229492 0.0 0.0 0.0 50.59012985229492 0.0 0.0 0.0 50.59012985229492" Properties=species:S:1:pos:R:3:forces:R:3 energy=-78.51369566929624 stress="-9.688742620545325e-05 8.63715279907686e-06 -2.5013734730946123e-05 8.63715279907686e-06 -9.998503675265875e-05 1.5471684124893665e-06 -2.5013734730946123e-05 1.5471684124893665e-06 -5.4315395925891536e-05" free_energy=-78.51369566929624 pbc="F F F" Cu 25.16001955 25.34759898 25.21389151 0.48442605 0.27475956 0.18755668 Cu 27.00260683 27.16949850 25.34369438 1.16624187 -2.57647637 -2.60461770 Cu 26.89056892 25.28001018 27.03520415 2.86266687 -2.38874015 -1.60524746 Cu 25.46231662 26.85471327 27.01923166 -3.65588175 2.25021398 0.04740229 Cu 29.15673898 25.68449029 25.26558271 -1.63828390 -1.03851303 -0.18814565 Cu 30.76361328 27.18660628 25.19334297 1.30673869 0.61509592 0.46538503 Cu 30.48130587 25.29575327 27.30705609 1.24910057 -2.61842110 -2.03088872 Cu 29.02783231 26.98101272 27.19387910 -2.49944743 1.62061445 -2.20721038 Cu 25.46962429 28.95450041 25.33907087 -2.59662686 -0.29810368 -1.35553981 Cu 27.13764763 30.48278056 25.31974527 0.88227884 0.61397469 0.16424214 Cu 26.95377898 28.63876235 26.87090878 2.49143382 2.29572476 4.49677610 Cu 25.24388220 30.50881448 27.23092847 0.72468184 1.71749555 -1.73846450 Cu 28.95855013 28.66069351 25.33622062 -0.53773105 0.81441923 -0.02269614 Cu 30.56065040 30.70580319 25.32237920 0.21483384 -0.77318797 -0.21400452 Cu 30.63186910 28.80336343 27.06933589 1.07783953 0.87443800 -0.54446315 Cu 28.97521031 30.89721842 26.90782252 -0.74806105 -0.87279763 1.39777419 Cu 25.45681689 25.29661583 28.81032227 -1.38625164 -1.26914508 1.28121209 Cu 27.02111958 26.86854263 28.72278252 0.73060853 3.34430795 1.65021643 Cu 27.03236826 25.26599986 30.90365733 1.00807227 -1.15976306 -0.59370611 Cu 25.53999154 26.87364302 30.73296219 -0.52547668 1.70460010 -0.51892562 Cu 28.72332359 25.44689996 28.82000263 0.15451427 -1.98308700 2.07132266 Cu 30.66372078 26.88918909 28.72146355 1.52929418 1.68103280 3.30700997 Cu 30.46790542 25.16912577 30.89946341 -0.94718218 0.91446318 -1.05641782 Cu 28.61303227 27.00729343 30.86989005 0.64542286 0.62046360 -0.85530390 Cu 25.21755131 29.05953821 28.76552331 0.72879805 -2.19022055 2.26656835 Cu 27.21104260 30.79872973 29.12631859 -3.04558346 1.24199624 -4.37399873 Cu 27.11180321 29.11886853 30.55935343 -2.34184461 -3.85101802 0.67533908 Cu 25.33170243 30.77573717 30.88526379 0.61326598 -0.56222786 -0.87204762 Cu 29.10743393 28.71633046 28.72722642 -1.56739880 1.18348975 1.69623498 Cu 30.73236128 30.87164718 28.92544357 -0.87123317 -0.95609824 -0.27796277 Cu 30.79023708 29.13957503 30.79112639 -0.88033089 -0.33185755 -0.99431065 Cu 28.70208794 30.49147858 30.48063891 5.37111542 1.10256753 2.34691125