4000 Lattice="42.3926105200626 0.0 0.0 0.0 42.3926105200626 0.0 0.0 0.0 42.3926105200626" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=384167.2785835092 pbc="F F F" Ne -0.03284614 0.00613795 -0.03144201 10 -138.33381079 -196.93289302 -187.05980629 Ne 1.10073857 1.04986028 -0.00785489 10 -134.54234556 10.42977311 -534.37886812 Ne 1.08713115 0.01099309 1.04095216 10 -92.14453425 -440.07149604 -2.68460724 Ne 0.00459173 1.07168160 0.97638476 10 -351.48755921 -11.31685402 151.60444109 Ne 2.19198633 -0.00773683 -0.02662355 10 -25.35548213 -302.92462866 -285.65132729 Ne 3.21057258 1.09071514 -0.02970322 10 -133.38825862 -34.26447506 -378.72023990 Ne 3.21702555 0.00047748 1.06577683 10 -177.86930225 -399.57009941 -108.57537878 Ne 2.09515627 1.05772059 0.99104602 10 215.90979599 61.54059989 242.90805969 Ne 4.24207958 0.03201646 -0.00232666 10 -26.23304474 -374.94471837 -410.84188238 Ne 5.27996523 1.08781211 0.00241226 10 120.64038093 -36.20315713 -379.32519353 Ne 5.27820182 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