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=40.35776801711964 stress="-3.2979978668953382 0.3501917376027967 -0.18819906520655394 0.3501917376027967 -5.906138432329254 -2.869528623437585 -0.18819906520655394 -2.869528623437585 -5.234925494118691" pbc="F T F" Ni 0.03851086 0.14982991 0.28095696 -41.87608748 -24.58186896 -63.33849791 Ni 1.32464588 1.76008946 0.28460712 34.95562775 -51.43272455 -75.18782394 Ni 1.25346517 -0.23227551 1.27715687 38.36993822 44.58295165 79.89381914 Ni 0.11893942 1.22956938 1.33885520 -31.44947849 31.43164187 58.63250271