256 Lattice="17.459678237540388 0.0 0.0 0.0 17.459678237540388 0.0 0.0 0.0 17.459678237540388" Properties=species:S:1:pos:R:3:forces:R:3 energy=-345.394003519449 stress="-0.002258201766145023 -0.001396615151154812 0.00016471377628041065 -0.001396615151154812 -0.009187101774051758 -0.0013873362163930477 0.00016471377628041065 -0.0013873362163930477 -0.012652241138706909" free_energy=-345.394003519449 pbc="F F F" Xe 0.00905029 0.02711322 0.01589161 -1.59370786 -0.89078008 -1.73368329 Mo 2.20216516 2.14571470 0.03055553 -1.55250776 2.50592929 0.74496936 Xe 2.22428245 0.00089007 2.21286476 -2.02300542 -2.47014775 1.92242382 U 0.00726477 2.18073908 2.09751421 0.89973035 1.58934950 0.13225328 Xe 4.34175311 0.03074600 0.01631058 1.31151273 -2.28147261 -3.46508191 U 6.56916417 2.12198533 0.01928985 1.82693672 0.31286166 0.88444475 U 6.52958936 0.01050323 2.18592394 1.96771385 0.60656093 0.59891118 Xe 4.32219476 2.20547057 2.14893268 2.00838788 1.09778718 2.14330669 Mo 8.71287877 0.03331798 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