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:Z:I:1:forces:R:3 energy=-2.178034796592913 pbc="F T F" Ni -0.20698176 -0.26758015 0.07255377 28 -6.45557517 4.23776202 -12.94792571 Fe 1.51129231 1.38069472 0.16911338 26 10.93517658 4.34200396 -13.81123502 Fe 1.30454100 0.12365747 1.45588739 26 17.29720109 -15.37400210 11.98883692 Ni -0.04702487 1.34681875 1.36894099 28 -21.77680250 6.79423612 14.77032382