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=-40.76758152301148 stress="-0.0005917345152309712 2.7758411359012203e-05 4.994056712816494e-05 2.7758411359012203e-05 -0.00046785785355627743 -0.00012498049053736045 4.994056712816494e-05 -0.00012498049053736045 -0.0005042786152917102" pbc="F F F" Al 20.91870436 21.04860922 21.20118821 -0.82017333 -0.38384819 -0.77241437 Al 22.70960170 22.31143450 22.33833517 -2.36543250 4.47864199 0.81095667 Al 23.78829595 20.83509776 21.14041416 2.05532433 -3.14318115 -2.79836737 Al 25.27812781 22.79098848 22.26215777 2.48560003 -1.44201352 0.99475019 Al 20.87679405 24.09027739 21.46238060 -3.12902358 -1.87865913 -1.58474685 Al 22.56504129 25.20865944 22.36550211 -5.33216810 8.94360460 7.66935883 Al 23.78802619 24.22277084 21.18584377 6.31339017 -4.04675999 -9.35042564 Al 25.40955323 25.48086654 22.83050726 1.01157073 0.94255996 -1.26396440 Al 21.26959405 21.17626233 23.85402479 -1.84954247 -0.75856217 1.48791118 Al 22.91285063 22.57550460 25.65300231 -1.70556277 -1.70431336 2.60013567 Al 23.83433719 20.95774659 23.86661612 2.02688873 -1.94333623 1.38502913 Al 25.45789336 22.60920173 25.50213148 1.09531343 -0.29965125 0.14339499 Al 21.19178619 24.17895518 24.47331198 -3.67108156 -2.72895234 -2.49034205 Al 22.43638857 25.53253581 25.64904689 1.79027522 3.51166907 3.12331146 Al 23.78091226 24.10609294 24.17823250 0.16954118 -1.35070366 -2.55320663 Al 25.23083399 25.45148263 25.29582048 1.92508048 1.80350537 2.59861921