4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-0.817759305090579 stress="-27.260777108381312 0.9971806246004338 1.6471373922633976 0.9971806246004338 -26.70667716681041 9.34582160666286 1.6471373922633976 9.34582160666286 -38.21726240384914" pbc="F F F" Ni 0.04376171 -0.27948471 0.19273990 -9.22260505 -7.24025786 -5.28378708 Ni 1.30722932 1.26172667 0.05332204 10.81892175 12.17444544 -22.57308735 Ni 1.38436473 0.23110688 1.49816022 9.87366510 -12.05353405 20.22177518 Ni 0.01283276 1.70071341 1.32858036 -11.46998180 7.11934647 7.63509925