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=-7.17994117270304 stress="-0.47034659095680553 0.017493727374261994 0.07243980322548342 0.017493727374261994 -0.4964418998456671 0.09172773032412167 0.07243980322548342 0.09172773032412167 -0.3601958247478151" pbc="F F T" Ni 0.01229390 0.24339277 -0.28843667 -5.27338902 -4.05004365 2.91083376 Ni 1.41738082 1.65093924 0.20761713 4.88431814 3.63174303 -0.26573935 Ni 1.26416454 0.14526935 1.53806039 4.89881491 -4.72330283 -1.18762765 Ni 0.07797747 1.76599513 1.67918122 -4.50974404 5.14160346 -1.45746676