256 Lattice="17.49958610534668 0.0 0.0 0.0 17.49958610534668 0.0 0.0 0.0 17.49958610534668" Properties=species:S:1:pos:R:3:forces:R:3 energy=-318.7442618434495 stress="-3.2786091909451045 6.400389788419552 -10.736419275795004 6.400389788419552 -7.161630734952638 -3.264421223512528 -10.736419275795004 -3.264421223512528 -21.571837761719934" pbc="F F F" Xe -0.03035307 0.03702163 -0.00742727 -0.44284792 -0.74912395 -0.26559910 U 2.12221805 2.19287176 -0.00664035 0.01088954 0.44851593 1.41674161 U 2.24391770 0.03115219 2.21015328 -0.48921573 1.12518224 0.64751156 U -0.01813506 2.18106892 2.22659683 1.66509900 0.63311520 1.19066617 U 4.35269084 0.01308448 -0.03934827 0.14337868 1.02601263 0.82691954 Mo 6.56058333 2.17678537 0.01054583 1.12439163 -0.38614582 0.46350083 U 6.58951100 0.02208332 2.17274323 -0.18516000 1.04931532 0.58961412 Xe 4.40747192 2.22380984 2.15036972 -1.35011737 -3.22512665 -1.00200131 Xe 8.74320632 0.00447532 -0.01705779 -1.01293751 -1.05313860 -2.07975804 U 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