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=-3.1074024200010335 stress="-0.003967953624454856 0.00016474639589938737 -0.0003984725442310614 0.00016474639589938737 -0.0037550072670170403 -0.00016609899279402916 -0.0003984725442310614 -0.00016609899279402916 -0.0040034144565806945" free_energy=-3.1074024200010335 pbc="F F F" Cu 20.88909689 21.11115480 21.11044915 -2.46540309 -6.53663666 -6.90877549 Cu 22.70960170 22.31143450 20.83833517 -6.24872896 6.46701915 -4.78004603 Cu 22.28829595 20.83509776 22.66640352 3.24528648 -8.28878141 -5.01398488 Cu 20.77812781 22.51878885 22.32834452 -3.36472126 5.12731336 4.65801791 Cu 23.87679405 20.95894820 20.92589040 3.31025591 -11.82193129 -1.19889470 Cu 25.52879565 22.11449487 20.86550211 5.57123581 3.44494953 -5.38921803 Cu 25.28802619 21.22277084 22.68584377 3.43846073 -23.74408318 -22.58010740 Cu 24.18362810 22.69581920 22.40244725 -8.89508286 -10.19784633 0.80409583 Cu 21.26959405 24.17626233 20.85402479 -10.24484308 -5.91681851 -14.74042898 Cu 22.70996341 25.49207130 21.15300231 -4.09661079 16.86600703 -16.75848025 Cu 22.53848316 23.95774659 22.12030630 -4.17634016 -13.14483090 12.93432993 Cu 20.95789336 25.38825682 22.27041603 -6.81232715 10.46861138 2.70917529 Cu 24.19178619 24.17895518 21.29140871 -4.67028083 -7.76712733 -36.10109590 Cu 25.61455359 25.53253581 21.14904689 5.27512599 7.24169781 -4.24569332 Cu 25.28091226 24.10609294 22.46603997 31.20403859 -1.37283897 12.68860787 Cu 23.80598025 25.32157598 22.51361598 4.96068388 22.82240522 13.35803395 Cu 20.85198705 20.97567541 24.06329927 -8.57715624 -3.35422518 -3.68962627 Cu 22.73620268 22.27846858 23.76742400 -2.84878954 8.27815289 4.17954620 Cu 22.34126820 20.84140700 25.31668137 3.53244112 -7.19155251 4.88767512 Cu 20.91986395 22.24396547 25.59073906 -2.75150523 6.12757044 4.03474644 Cu 24.27219963 20.93381326 24.13132919 -9.50574106 -10.00252136 3.25650773 Cu 25.75978669 22.22592512 23.78504734 14.13246894 20.44469975 18.03298485 Cu 25.56455903 21.06425382 25.58343331 6.34604857 -2.51573350 5.74305652 Cu 23.85420938 22.19455091 25.70287922 -0.86411673 6.38464311 4.92178168 Cu 21.23171545 24.18190327 23.74185363 -6.17215685 -7.46384069 2.71726812 Cu 22.71219253 25.42485375 24.12990665 -5.15812069 14.40187914 -8.46043617 Cu 22.28220450 24.28278197 25.56210000 11.55639069 -28.67649247 8.64761859 Cu 21.13362859 25.32702941 25.57034430 -22.40387546 19.50511882 3.62570330 Cu 24.04852473 24.05473499 23.91561068 -6.35057310 -10.27652608 3.17038771 Cu 25.63661615 25.40480033 24.07789707 5.85689216 12.08193517 -5.57804517 Cu 25.29869006 24.11041876 25.26735611 10.41597090 -12.58839012 12.98536387 Cu 23.83533445 25.24148635 25.58611608 6.76107334 11.19817371 12.08993168