108 Lattice="13.06805487397191 0.0 0.0 0.0 13.06805487397191 0.0 0.0 0.0 13.06805487397191" Properties=species:S:1:pos:R:3:forces:R:3 energy=-134.89531254263164 stress="-0.004021740195859668 0.002304692331344764 -0.0005228688422538854 0.002304692331344764 -0.014905229521643382 -0.0007224649725256706 -0.0005228688422538854 -0.0007224649725256706 -0.009061888745892827" pbc="F F F" U 0.00090729 0.04049896 0.04138931 0.86220249 1.25674214 2.19862716 Xe 2.17856064 2.13578396 0.01261560 0.05862389 -0.50528770 -2.67801598 U 2.19508678 0.03634437 2.15111263 -0.60609834 -0.31739838 -0.73833872 U 0.03095150 2.21285726 2.16458453 -0.46029145 -1.16882540 -0.22048088 Mo 4.34291436 0.03828713 0.02300496 -0.17784086 1.11599267 1.30068777 Mo 6.55226621 2.24897237 0.01666236 -1.65316686 -0.02853286 1.68221922 Xe 6.55033298 0.03425338 2.15938731 -0.48408717 -1.82457032 -2.11530376 Mo 4.32732571 2.10799568 2.18925096 1.89706843 0.27587970 -2.43428495 U 8.71412514 0.03265960 0.01467288 0.73868652 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