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=16886.8435349574 stress="-2454.8189436120333 235.56039671889732 -1267.37808167013 235.56039671889732 -2197.271657510708 -957.1579904196745 -1267.37808167013 -957.1579904196745 -3262.9100904326974" pbc="F F T" Nb 0.26803846 0.28482528 0.10989056 -36411.71431486 -27825.99727323 -47235.17972578 Nb 1.66315055 1.78203868 -0.26044931 10699.06731657 10399.20720869 1921.27671968 Nb 1.55080407 0.17064374 1.36812341 38424.90635630 -12483.14420175 26914.89383271 Nb 0.10570971 1.70011284 1.28471420 -12712.25935802 29909.93426629 18399.00917339