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=-0.49546177090271626 stress="-48.15334804747728 -2.9910122180796446 -17.465063481536074 -2.9910122180796446 -42.729101475636476 6.657421736447976 -17.465063481536074 6.657421736447976 -43.427302221482805" pbc="F F F" Nb 0.26235339 -0.15161904 0.21005355 -23.37639985 -11.99498030 -23.50614999 Ni 1.71211731 1.44968690 0.29594673 9.04635983 19.00595936 -15.75418308 Nb 1.65710459 -0.00957146 1.35687199 23.52624743 -16.04414439 30.42945500 Ni 0.02040583 1.46174430 1.32924225 -9.19620741 9.03316533 8.83087807