64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=58123.05290551272 stress="-0.6272886090014632 -0.05406518753713906 -0.1464020517190268 -0.05406518753713906 -0.8014975339234478 0.11661929798200865 -0.1464020517190268 0.11661929798200865 -0.6100865037346256" free_energy=58123.05290551272 pbc="F F F" Kr 34.83451651 35.10535810 35.39397009 -3364.44240812 -1487.42528646 -1011.29510966 Kr 36.33268130 35.76741069 35.84410269 3218.75128509 1431.93113433 887.69747853 Kr 36.64919348 37.61204406 34.82226869 14.65711861 151.53838644 -111.92557585 Kr 37.98134164 39.07917266 36.28232034 308.99535930 -385.63661408 -996.08822027 Kr 37.24217325 34.85297404 37.47687593 -3430.39324455 -3083.90043357 -2314.43543685 Kr 38.35961812 35.78492223 38.26964376 3403.28500826 2953.26945086 2375.73303393 Kr 35.05236494 37.39055695 37.67204097 -15.75638307 0.30921325 -10.54453492 Kr 36.55604684 39.07636534 38.99475015 -40023.57576171 73031.47909882 -37449.99794328 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41.22892384 41.12165250 11568.83325632 -20423.15917690 -23455.79903204 Kr 42.42514645 42.72433644 39.45486603 749.38154957 462.00468412 815.95217300 Kr 43.90918678 43.68770482 41.32374220 9.50247990 6.47366968 11.68075734 Kr 42.89864609 40.36253528 42.01114327 -52.95792816 -157.72953455 -291.08096869 Kr 43.43271795 41.23545638 43.76561610 97.48224892 158.53790342 319.57281686 Kr 40.39757659 42.11536967 42.13716159 -11343.59532768 20688.83160763 23126.23299150 Kr 41.35328338 44.02988149 43.99820222 1.37989173 3.22006738 2.91201214