16 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=-40.028688783190596 stress="0.00022538687612352364 -6.589417169004309e-05 1.8754713779140618e-05 -6.589417169004309e-05 0.00021387803792960786 2.3444248587689222e-05 1.8754713779140618e-05 2.3444248587689222e-05 0.00019108961442948057" pbc="F F F" Fe 21.03585619 21.01966008 21.47516499 0.02089730 0.01278904 -0.87236803 Fe 22.33383177 22.32433566 22.67928512 4.33194314 5.40406352 -3.13701329 Ni 23.92570064 21.12853427 20.79424681 -0.87896116 1.61050962 1.57445409 Fe 25.28782022 22.45521656 22.42401867 -1.35024949 0.71233272 0.27361788 Fe 20.82910290 23.95491083 20.84146038 1.30232925 -0.83199703 1.40257759 Fe 22.66374685 25.55525431 22.25671679 0.79352903 -1.99449719 0.75115006 Ni 24.08442254 23.95525223 20.89016040 -1.16934652 -1.10748543 1.26815679 Ni 25.47640297 25.24114677 22.22736499 -1.04924883 -0.81715795 1.11922339 Ni 21.25278033 21.09200417 23.88382773 -1.86831685 -1.94175944 3.04519860 Fe 22.70202332 22.93869350 25.43381024 -0.73712989 -0.11845895 -0.03449065 Fe 23.73677887 21.25823677 24.27093457 -0.47534963 -0.77543617 -1.22202413 Ni 25.39797255 22.23155877 25.42113482 -0.08765460 1.75642986 -0.31780788 Ni 20.79375489 23.63858343 24.06194135 1.52470339 0.03049289 -0.46259185 Fe 22.37455773 25.40855725 25.25979631 0.81727679 -0.99108754 -1.29850186 Ni 24.25366786 24.05114214 24.04997140 -0.77291398 -0.70232553 -1.78639447 Ni 25.46055881 25.41062519 25.37728820 -0.40150795 -0.24641241 -0.30318623