500 Lattice="17.502930087726142 0.0 0.0 0.0 17.502930087726142 0.0 0.0 0.0 17.502930087726142" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2053.2623012333147 stress="-0.007155906430487965 0.00048223131217387156 0.0005931390297443587 0.00048223131217387156 -0.007345054101117426 0.0001792014735875653 0.0005931390297443587 0.0001792014735875653 -0.007008829614686523" pbc="F F F" Ni 0.00351779 0.02350526 0.02563304 0.25380631 0.17479443 0.20245652 Ni 1.74482174 1.73428570 0.03220879 0.50006058 0.24168269 -0.56271922 Ni 1.71972389 0.03329140 1.77666511 0.56909873 -0.52697362 -0.06563105 Ni 0.02405249 1.74844536 1.72109490 -0.58181745 0.26114425 0.60820322 Ni 3.51780130 0.00984604 0.03815531 -0.22723048 0.07983341 -0.03018811 Ni 5.28463336 1.75246571 0.02207502 -0.12335049 0.47365220 -0.28827484 Ni 5.23103615 0.02894996 1.73426236 0.32121307 -0.35086379 0.52426120 Ni 3.51575533 1.77807798 1.74065043 -0.09123586 -0.19186558 0.20440134 Ni 7.01515937 0.03538940 0.01237406 -0.06422951 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0.18088524 -0.44638149 Ni 15.74113460 5.27260678 0.04129084 -0.04375845 -0.19125913 -0.09351560 Ni 15.74641393 3.49069413 1.73042434 0.12199369 0.19588993 0.51989807 Ni 13.99753552 5.28090608 1.73230229 0.00069829 -0.41515315 0.39467806 Ni 0.01858407 6.98968975 0.00963009 -0.06563434 0.11942063 -0.00892093 Ni 1.75793918 8.74166068 0.03011112 0.21769027 0.22551102 -0.39449987 Ni 1.73392284 7.01380273 1.75397141 0.29041599 -0.32057330 0.22533782 Ni 0.03080248 8.72685981 1.75981600 -0.47804622 0.23619796 0.21333627 Ni 3.48254085 6.98021953 0.01670220 0.05450454 0.03469222 -0.36954286 Ni 5.20774731 8.73546363 0.00451654 0.39549173 0.13863758 -0.23246088 Ni 5.26402002 6.98954088 1.73521861 -0.26957853 -0.10231337 0.32459503 Ni 3.49773204 8.74274585 1.75019392 0.17142952 0.26410703 0.21390624 Ni 7.02698165 6.97797333 0.03222106 -0.22606705 0.26270406 -0.55850794 Ni 8.73736857 8.78443564 0.03469465 -0.06795585 -0.02319861 -0.49417099 Ni 8.74783019 7.01715188 1.76062319 0.12811959 -0.15242802 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