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=-45.967877077246136 stress="4.877804273038921e-05 7.442520344465555e-05 6.992381074137715e-05 7.442520344465555e-05 9.036728093165344e-05 -3.412192172109868e-05 6.992381074137715e-05 -3.412192172109868e-05 5.888346307257973e-05" free_energy=-45.967877077246136 pbc="F F F" Cu 20.85540510 21.11115480 21.11044915 0.70195815 0.47381166 0.45087304 Cu 22.70960170 22.31143450 22.33833517 -1.41246532 2.43147836 0.93354834 Cu 23.78829595 20.83509776 21.14041416 0.52722568 -1.02750822 -0.91377285 Cu 25.13011487 22.51878885 22.32834452 0.22847103 0.90456346 0.29553279 Cu 20.87679405 23.95894820 21.20259391 0.45810690 -0.46542059 0.64682010 Cu 22.56504129 25.20865944 22.36550211 -3.78777555 3.33587001 3.86564508 Cu 23.78802619 24.22277084 21.18584377 3.85470308 -3.42282962 -3.42013160 Cu 25.68362810 25.69581920 22.62252551 -1.29748463 -1.10216302 0.43428869 Cu 21.33289332 21.17626233 23.79147921 -0.12989542 0.22878241 0.26740278 Cu 22.48843198 22.49207130 25.65300231 0.60621285 0.41600720 -0.96939998 Cu 24.03299744 20.95774659 23.75978977 -0.23112954 0.21838140 0.50892964 Cu 25.45789336 22.38825682 25.27041603 -0.86704747 0.56750742 -0.54671649 Cu 21.03319318 24.17895518 24.29140871 0.68071723 -0.67030671 -0.95852126 Cu 22.61455359 25.53253581 25.64904689 0.26762489 -0.67932165 -0.62214286 Cu 23.78091226 24.10609294 23.96603997 0.44472246 -0.87107840 0.50906958 Cu 25.12266162 25.32157598 25.51361598 -0.04394435 -0.33777370 -0.48142500