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=-6.678259189984803 stress="-0.0010442248507763214 -2.285842238604764e-05 0.00012135763708554676 -2.285842238604764e-05 -0.0008216563298355471 0.00015747443842432284 0.00012135763708554676 0.00015747443842432284 -0.0008870590195427889" pbc="F F F" Mo 21.23572307 20.81631184 20.72041701 0.66774802 -0.41237775 -0.41142950 Mo 22.21755886 22.06116856 22.39917148 5.75392243 7.48682630 -8.82537309 U 24.23198562 21.00424309 21.11400901 1.94470723 -0.25938928 -0.78958032 U 25.71211731 22.28195290 22.79594673 3.02227929 1.43174674 -3.58969094 Xe 21.15710459 23.72092454 20.85687199 -7.95291669 2.33322264 -5.43858375 Xe 22.59700443 25.74122900 22.52201293 -0.95980964 7.79105418 -0.11467015 U 23.81634348 23.88165489 20.98566276 7.60965720 -0.47607398 -2.23107364 Mo 25.56287025 25.54376171 22.36484190 -1.22904765 -2.40695670 0.16995403 Xe 21.19273990 20.80722932 23.76172667 -16.19381587 -11.59661282 9.42532516 U 22.55332204 22.38436473 25.73110688 -6.40842074 6.72328155 7.62521398 Xe 23.75839514 21.01283276 24.20071341 7.64229117 -13.43819777 -3.83052401 Xe 25.32858036 22.64720807 25.58942344 7.55462848 -0.02247561 7.26600575 Mo 20.95706424 24.52409723 23.71321713 -1.03609517 -1.33407814 2.30950609 Mo 22.97648335 25.47624104 25.55816002 0.98816431 -0.54132144 0.32519545 Mo 23.79224623 23.73214964 23.78052736 -0.13565857 2.91378536 -0.74237056 U 25.48938743 25.35444624 25.57690808 -1.26763381 1.80756673 -1.14790449