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=4.78651270905324 stress="-3.0597094325039076 0.07398948893797348 0.04450457598284484 0.07398948893797348 -1.9084481308758132 0.03477596164316652 0.04450457598284484 0.03477596164316652 -2.14511646020864" pbc="T F F" Ta -0.14801295 0.06329927 0.09073906 6.83603112 -22.52504363 -19.84731830 Ta 1.77219963 1.43381326 0.13132919 -7.43090447 20.28477367 -19.57652853 Ta 1.75978669 0.18365717 1.70288723 -6.70135709 -18.85122923 20.41104026 Ta 0.08343331 1.29585403 1.44809454 7.29623044 21.09149919 19.01280657