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=1865.7496196550603 stress="-0.013384969237087955 0.0032966834531193523 -0.004521626430017801 0.0032966834531193523 -0.013454876782671434 0.00010783242618196078 -0.004521626430017801 0.00010783242618196078 -0.01631014047919994" free_energy=1865.7496196550603 pbc="F F F" U 35.49028470 35.34013519 35.03091681 -270.45903347 -379.51493048 -285.81384206 U 36.18145323 36.31152306 35.76128550 263.56205529 366.93209837 273.42105374 U 38.01161686 38.21548943 35.32905810 -14.57140607 -29.18045786 -20.69873947 U 38.90607387 39.64368956 36.50684823 198.82882251 -18.14846285 36.36111687 U 37.62793321 34.81339034 37.99163138 -321.37230186 -463.05820079 -132.87123233 U 38.40999668 35.93522116 38.30556638 292.39659491 462.35101775 93.18250537 U 35.22920989 38.18300210 37.18203400 -35.48445758 -11.33985953 -15.73528957 U 36.51981643 38.58908153 38.64301856 -84.41683544 198.00918845 -100.29597733 U 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