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=3.8438701458918714 stress="-0.0003574342076839336 1.726549342196846e-05 -0.0002759734241382235 1.726549342196846e-05 -0.00046262923128571746 4.8826086047531e-05 -0.0002759734241382235 4.8826086047531e-05 -0.00034041411423654696" pbc="F F F" Cd 21.01220292 20.75039125 21.08902900 -0.00460049 -0.03339280 -0.01460184 Cd 22.37212783 22.62744689 22.46179749 0.44367393 -2.10693280 1.90628662 Cd 24.10648835 20.81649600 21.21224302 -1.64105741 -2.34932387 -1.42546764 Cd 25.23219888 22.46377771 22.23026213 10.36783371 -7.65307115 9.57594894 Cd 21.42614083 24.02672168 20.93367479 -1.40751187 1.21666473 -1.99099553 Cd 22.76139998 25.34546349 22.59243610 -1.21133611 2.52450134 -1.48753275 Cd 24.11841611 23.74259872 21.16219340 -7.76630496 9.94040286 -9.00835141 Cd 25.62002127 25.50114972 22.67074118 0.31237510 0.26878599 -0.17150844 Cd 21.13953550 20.93684347 24.21395475 -0.58024230 -0.62791019 -0.66537279 Cd 22.45320675 22.30708033 25.68714475 0.70728740 0.56503934 0.73415304 Cd 24.27038923 20.75804258 24.25456015 -0.22116945 -0.18476888 -0.25888184 Cd 25.57688568 22.44421063 25.69112658 0.12305105 0.25960172 0.14747089 Cd 21.27415876 24.20504604 24.27878186 -6.94179850 -7.18097289 -5.22367424 Cd 22.46542011 25.52851792 25.30078814 6.29542737 7.31877913 5.78577466 Cd 24.00793522 24.00737721 23.91348260 1.58220541 -1.90067960 2.14089596 Cd 25.62229619 25.71622866 25.62409535 -0.05783288 -0.05672294 -0.04414362