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=6.391042959522578 stress="-1.5357108892551763 0.6592284443096441 -0.16855642632355897 0.6592284443096441 -1.618043450006513 0.3644840359011581 -0.16855642632355897 0.3644840359011581 -1.0235905963335592" pbc="T F F" Be -0.05190546 0.22094491 0.23171545 0.09403098 -11.38090236 -11.36629750 Be 1.68190327 1.32183498 0.21219253 -6.61981223 24.05210905 -13.10669129 Be 1.25188316 0.12990665 1.28220450 13.45039569 -23.88120200 19.71389986 Be 0.28278197 1.56210000 1.63362859 -6.92461444 11.20999531 4.75908893