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=223.22451847307914 stress="-0.022274518955901348 0.0044502713525513184 -0.011274145679409061 0.0044502713525513184 -0.02382997611219371 0.01052899075700781 -0.011274145679409061 0.01052899075700781 -0.021573230277192552" pbc="F F F" U 21.13542383 21.21009568 20.72618480 -4.34597297 -3.50783593 -6.16850175 Xe 22.42139044 22.28901754 22.48006896 -298.68699134 750.40311495 -714.56269077 Mo 23.87035017 20.81690394 20.98423457 -0.62737418 -2.66737484 -3.08661514 Xe 25.33596086 22.37010416 22.25571765 181.00235047 -186.90470701 177.44596889 Mo 21.35348429 23.92499205 20.90069695 -2.39262444 0.77453952 -1.58208322 U 22.53623544 25.56079868 22.36178221 -5.78950576 7.58055509 -5.34341341 Xe 24.14120549 23.71562917 20.97717101 -168.32772131 187.72612697 -192.30775255 U 25.30181751 25.34283558 22.35376542 7.63516552 8.79263439 2.75243817 Xe 21.18292312 21.00795275 23.74043896 -245.46260023 -239.26405220 231.99783600 Mo 22.71547056 22.51635763 25.36828723 43.04728133 -38.54794794 39.67688772 Xe 23.66107685 21.06594471 23.63031703 537.28455636 -526.22619592 491.37194322 Mo 25.34206717 22.29638512 25.65159246 -1.06088957 1.32626184 -0.61217185 U 21.25900491 23.88008494 24.25685297 -200.65044722 -195.68808359 -200.92580184 Mo 22.22370441 25.39465040 25.34292737 114.45465094 264.25601569 208.40714463 U 23.71996297 24.42881726 23.90374220 -54.54701741 -93.65044555 -133.51195587 Mo 25.10517004 25.36717223 25.40233899 98.46713981 65.59739454 106.44876777