108 Lattice="13.078650677953682 0.0 0.0 0.0 13.078650677953682 0.0 0.0 0.0 13.078650677953682" Properties=species:S:1:pos:R:3:forces:R:3 energy=-138.46196692313438 stress="-0.003872015687711564 -0.00019080866950662895 -0.002255631359712832 -0.00019080866950662895 -0.006261596857720487 0.0010258461247139733 -0.002255631359712832 0.0010258461247139733 -0.008703942150391485" free_energy=-138.46196692313438 pbc="F F F" Xe 0.00837131 0.02962200 0.00631211 -0.79617539 -1.03549002 -0.98945548 U 2.14744094 2.22185961 0.02809097 0.88250565 0.78888380 1.03062588 Mo 2.19108013 0.00472202 2.17182010 2.01232112 1.33579120 -1.06251625 U 0.04312232 2.17181875 2.15239613 1.55736506 1.33516017 -0.58155504 Mo 4.39156024 0.03862718 0.03864608 -0.48503832 1.97160730 2.06271506 Xe 6.53981637 2.16882624 0.03292492 -1.14864845 -0.37072011 -2.65414272 Mo 6.56836167 0.01158867 2.18225582 -0.60686088 -0.04597039 0.54857766 U 4.35852623 2.15259972 2.21165415 -1.06694701 -1.29119897 -0.48627947 U 8.73424155 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