32 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=-4.004655179522558 stress="-0.003666954905064275 0.00021495110924902314 -0.0003367815018596146 0.00021495110924902314 -0.0036227311509841775 -8.273802235844134e-05 -0.0003367815018596146 -8.273802235844134e-05 -0.003798549661897406" free_energy=-4.004655179522558 pbc="F F F" Cu 20.88909689 21.11115480 21.11044915 -2.57801027 -6.10568135 -6.49275542 Cu 22.70960170 22.31143450 20.83833517 -8.11412610 12.15086094 -7.74670143 Cu 22.28829595 20.83509776 22.66640352 0.57639016 -8.14609965 -1.55436758 Cu 20.77812781 22.51878885 22.32834452 -3.63522544 3.79728678 3.77607202 Cu 23.60009055 20.95894820 21.16634827 10.09875194 -15.79713981 -1.35633257 Cu 25.56504129 22.11449487 20.86550211 2.70294042 1.52216467 -4.84540492 Cu 25.28802619 21.22277084 22.68584377 3.66693655 -21.24892015 -20.00884447 Cu 24.18362810 22.69581920 22.40244725 -7.63250252 -8.90998448 0.82481733 Cu 21.26959405 24.17626233 20.85402479 -9.56977677 -5.52572078 -13.89819324 Cu 22.70996341 25.49207130 21.15300231 -3.58330500 15.81895836 -15.47685836 Cu 22.53848316 23.95774659 22.12030630 -2.34956903 -12.50248682 10.18711884 Cu 20.95789336 25.38825682 22.27041603 -7.32661481 13.01944318 -0.13922107 Cu 24.19178619 24.17895518 21.29140871 -3.71893136 -7.21605452 -32.93711242 Cu 25.61455359 25.53253581 21.14904689 5.13157145 6.93831999 -4.19995323 Cu 25.28091226 24.10609294 22.46603997 28.00928721 -3.65847047 9.08305907 Cu 23.80598025 25.32157598 22.51361598 3.78024286 21.37852611 11.63375390 Cu 20.85198705 20.97567541 24.06329927 -8.15243924 -3.23597254 -3.43827124 Cu 22.73620268 22.27846858 23.76742400 -2.87513590 7.48488488 3.27128681 Cu 22.34126820 20.84140700 25.31668137 4.43024194 -6.36169282 4.90159342 Cu 20.91986395 22.24396547 25.59073906 -2.69288809 5.91216726 3.76445738 Cu 24.27219963 20.93381326 24.13132919 -8.13452942 -7.90777869 6.32242927 Cu 25.75978669 22.22592512 23.78504734 12.79514322 18.19281745 15.74495386 Cu 25.68365717 21.08378910 25.58343331 2.31791679 -0.72651003 4.30102132 Cu 23.65722062 22.50644989 25.72094491 1.86162991 0.79652567 3.30453533 Cu 21.23171545 24.18190327 23.56829135 -5.18822659 -7.70538125 9.66543120 Cu 22.71219253 25.42485375 24.12990665 -5.37760762 13.00677691 -7.57442288 Cu 22.28220450 24.28278197 25.56210000 7.99461015 -24.58573917 6.83648793 Cu 21.13362859 25.32702941 25.57034430 -19.70040685 16.40976489 2.48649414 Cu 24.04852473 24.05473499 23.91561068 -5.83743425 -9.47762839 3.15749047 Cu 25.63661615 25.40480033 23.85912935 5.48452164 9.70822457 0.27816278 Cu 25.29869006 24.11041876 25.26735611 11.02410421 -7.60380488 9.07064133 Cu 23.83533445 25.24148635 25.58611608 6.59244082 10.57834416 11.05863243