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=13.544895208528716 stress="-0.007126196417128311 0.0008767754968754726 -0.0014222124091639943 0.0008767754968754726 -0.0069269070820682935 -0.0006857417023111812 -0.0014222124091639943 -0.0006857417023111812 -0.008242467207543638" free_energy=13.544895208528716 pbc="F F F" Ni 20.88909689 21.11115480 21.11044915 -23.29900920 -14.14269958 -38.11681845 Ni 22.70960170 22.31143450 20.86432452 -14.77545810 21.12781584 -4.10653205 Ni 22.01159245 21.13384602 22.41332388 51.96838088 -14.43706206 12.82042075 Ni 20.83648316 22.51878885 22.32834452 -16.15759630 29.62733693 10.28795027 Ni 23.87679405 20.95894820 20.94905028 13.86736138 -21.29953736 0.55825579 Ni 25.54697560 22.12867809 21.06620414 5.31658901 9.64115595 -14.83238576 Ni 25.28802619 21.22277084 22.68584377 4.62686149 -60.90738136 -50.76870186 Ni 24.18362810 22.69581920 22.64685009 -23.33788025 -11.83240150 -8.71581187 Ni 20.97302364 24.17626233 20.85402479 -1.33228801 -11.69009801 -14.68176191 Ni 22.70996341 25.49207130 21.15300231 -18.87529653 14.35211342 -30.06865194 Ni 22.53848316 23.95774659 22.31937324 -11.46093469 -21.30031893 1.53091204 Ni 20.95582883 25.38825682 22.27041603 -4.34776168 19.43452578 5.94838675 Ni 24.19178619 24.17895518 21.29140871 -24.43293730 -28.76060295 -72.40792864 Ni 25.62456551 25.53253581 21.13358029 6.46567729 12.36317704 -9.50668085 Ni 25.28091226 24.20779414 22.46603997 61.95530094 -33.15999062 11.31514201 Ni 23.80598025 25.32157598 22.51361598 6.50168811 53.24676205 35.33938461 Ni 20.85198705 20.85360906 23.78234313 -16.31386196 -5.23875404 15.65775028 Ni 22.43828044 22.27846858 24.24075525 -13.76088117 21.18197104 -37.14035236 Ni 22.34126820 20.84140700 25.31668137 10.17118981 -37.93729395 11.02548693 Ni 21.06288796 22.09895440 25.70116765 -16.87874235 14.75832223 7.12900946 Ni 24.27219963 20.93381326 24.13132919 -26.75282984 -11.79188435 8.54280507 Ni 25.75978669 22.22592512 23.78504734 26.97975057 46.48064044 42.60097569 Ni 25.53878567 21.25569436 25.49677214 9.99923052 -0.21359631 15.08243804 Ni 23.64240894 22.32050690 25.54325335 20.83401672 6.87894029 22.14400977 Ni 21.23171545 24.18190327 23.73232657 -8.68880361 -15.06957110 5.86933102 Ni 22.71219253 25.42485375 24.12990665 -8.75801575 23.50208769 -22.93891964 Ni 22.28220450 24.28278197 25.56210000 23.87899208 -61.77339748 24.00454465 Ni 21.13362859 25.32702941 25.29320850 -50.55125773 45.56992387 0.31742874 Ni 24.04852473 24.05473499 23.91561068 -14.95882767 -8.62040251 14.64537544 Ni 25.57519687 25.40480033 23.62924925 10.11704759 30.42766101 26.27963232 Ni 25.29869006 24.11041876 25.26735611 25.26695242 -10.83688484 12.51981886 Ni 23.83533445 25.24148635 25.58611608 16.73334333 20.41944337 19.66548686