16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-35.06470119410268 stress="0.00015917112254270124 8.474127067915962e-05 7.956607653399724e-05 8.474127067915962e-05 0.0001558538356338684 -4.012266017155415e-05 7.956607653399724e-05 -4.012266017155415e-05 0.0001385643320182076" free_energy=-35.06470119410268 pbc="F F F" Cu 20.85540510 21.11115480 21.11044915 1.03825072 0.84014857 0.86395654 Cu 22.70960170 22.31143450 22.33833517 -1.52190693 2.43909900 1.44611087 Cu 23.64028300 20.83509776 21.11608958 0.60969225 -0.97628422 -0.58970985 Cu 25.27812781 22.51878885 22.32834452 -0.79673400 0.40767094 0.60221627 Cu 20.87679405 23.95894820 21.20259391 0.82884110 -0.97877337 0.65235065 Cu 22.56504129 25.20865944 22.36550211 -3.64880362 2.92852047 3.37035711 Cu 23.78802619 24.22277084 21.18584377 3.58481163 -2.97510117 -2.71837240 Cu 25.68362810 25.69581920 22.64685009 -1.36205264 -1.23770865 0.65466551 Cu 21.26959405 21.17626233 23.91732405 0.74938154 0.73327336 -0.42284907 Cu 22.70996341 22.49207130 25.65300231 0.43650932 0.44045526 -1.24879743 Cu 24.03848316 20.95774659 23.85597600 -0.49775114 0.65209304 -0.04457112 Cu 25.45789336 22.38825682 25.27041603 -1.08729553 0.87120489 -0.78594290 Cu 21.19178619 24.17895518 24.29140871 0.77618053 -0.84618732 -0.71015374 Cu 22.61455359 25.53253581 25.64904689 0.81970513 -0.63434981 -0.46739363 Cu 23.78091226 24.10609294 23.96603997 0.92602102 -0.93805170 0.37530124 Cu 25.30598025 25.32157598 25.51361598 -0.85484938 -0.72600929 -0.97716804