4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-4.339117213352868 stress="-10.254822720719998 -1.9619518061952153 1.4807884559685025 -1.9619518061952153 -14.646617414623245 9.264677191781038 1.4807884559685025 9.264677191781038 -14.47547341473653" pbc="F F F" Mo -0.27442627 -0.09022051 0.14408857 -3.11871393 -2.65753026 -0.92439993 Xe 1.47537525 1.70902946 -0.20409991 3.14357148 7.51219233 -7.36215735 U 1.66265408 -0.04125212 1.54052745 2.46536252 -5.77716077 5.87523135 Mo -0.26582914 1.44170993 1.68168807 -2.49022008 0.92249870 2.41132593