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=-7.71235485185 stress="-8.888418239592752 -1.3837156100882209 -1.0198915429407036 -1.3837156100882209 -8.890918302817946 1.9095993511274698 -1.0198915429407036 1.9095993511274698 -8.10363111479814" pbc="F F F" Ta 0.15488783 0.05988540 -0.29754255 -18.61457997 -12.30478051 -12.43240478 Ta 1.66431082 1.31425730 -0.01155935 16.44103388 23.65789313 -11.76213155 Ta 1.53277713 -0.10028026 1.37366136 11.97308627 -19.83955605 17.43490918 Ta -0.03902326 1.28219307 1.71813893 -9.79954018 8.48644343 6.75962715