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=440.63897322075 stress="-1113.720878082968 190.14093613366788 -133.37400541772524 190.14093613366788 -862.5717360924581 81.46856049874248 -133.37400541772524 81.46856049874248 -580.1681736475805" pbc="F F F" U 0.21456242 0.27913633 -0.14736324 -467.98474578 -141.81575625 -302.19655297 Mo 1.68492541 1.33178173 0.00917070 439.22066256 205.85131124 -128.57348683 Mo 1.26192411 -0.03509031 1.26260376 511.34546487 -533.35366124 288.84611862 Xe 0.35475967 1.29825187 1.21273724 -482.58138164 469.31810625 141.92392119