500 Lattice="7.654791912023244 0.0 0.0 0.0 7.654791912023244 0.0 0.0 0.0 7.654791912023244" Properties=species:S:1:pos:R:3:forces:R:3 energy=-12267330.436043058 stress="-11973.144787215499 -86.73205666122726 -728.5608789102537 -86.73205666122726 -17340.415103923577 -250.50570651527326 -728.5608789102537 -250.50570651527326 -9961.512378950918" free_energy=-12267330.436043058 pbc="F F F" Cu 0.00390968 0.00966057 0.01359061 -187789.61097427 -185263.37646086 -184052.53227237 Cu 0.77398902 0.75705911 0.01200330 -349049.39286828 -381289.54687063 -1007596.95586343 Cu 0.75859638 0.00142987 0.78412710 -365388.45152338 -991391.31296968 -315034.86792587 Cu 0.01189026 0.78143861 0.75917290 -996446.78686916 -371038.91963035 -363412.82235885 Cu 1.51644394 0.00221171 0.00250764 8117.98110903 -611066.68173228 -619180.76347647 Cu 2.28304110 0.76472739 0.01361643 -133995.00419647 -418821.87128344 -1772967.03680233 Cu 2.30084422 0.00902547 0.75690018 -107311.71068864 -1798721.20112773 -411966.07423362 Cu 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