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=-37.67667664444546 stress="0.00011321146496083761 7.980409150549772e-05 6.534329118541981e-05 7.980409150549772e-05 9.110104878221616e-05 -3.318279704799342e-05 6.534329118541981e-05 -3.318279704799342e-05 9.478209179083545e-05" free_energy=-37.67667664444546 pbc="F F F" Cu 20.85540510 21.11115480 21.11044915 0.89585618 0.52852538 0.73359521 Cu 22.70960170 22.31143450 22.33833517 -1.17985425 2.49203551 0.74708387 Cu 23.64028300 20.83509776 21.11608958 0.40188031 -1.10393975 -0.50830535 Cu 25.27812781 22.51878885 22.32834452 -0.56970685 0.46069806 0.57784569 Cu 20.87679405 23.95894820 21.20259391 0.68621453 -0.78488068 0.78968911 Cu 22.56504129 25.20865944 22.36550211 -4.28849687 3.37521462 2.30637352 Cu 23.78802619 24.22277084 21.18584377 3.60489248 -2.79075278 -2.74776444 Cu 25.68362810 25.69581920 22.64685009 -0.95952847 -1.17477969 0.55283736 Cu 21.26959405 21.17626233 23.91732405 0.71043327 0.55914417 -0.31824531 Cu 22.70996341 22.42952572 25.65300231 0.45845512 0.27747063 -1.23492376 Cu 24.03848316 20.95226087 23.75978977 -0.55327017 0.22291671 0.28796220 Cu 25.45789336 22.38825682 25.27041603 -0.96897057 0.63726549 -0.82136944 Cu 21.19178619 24.17895518 24.29140871 0.50312254 -1.00431391 -0.81414624 Cu 22.61455359 25.53253581 25.49045389 0.91371394 -0.36294817 0.07149269 Cu 23.78091226 24.10609294 23.78272134 1.08732433 -0.73469878 1.43296722 Cu 25.30598025 25.32157598 25.51361598 -0.74206553 -0.59695681 -1.05509232