4 Lattice="3.25 0.0 0.0 0.0 3.25 0.0 0.0 0.0 3.25" Properties=species:S:1:pos:R:3:forces:R:3 energy=-14.978743110489766 stress="-48.01323677997632 -6.864958722408914 2.213029294952861 -6.864958722408914 -47.97593971292948 1.3002898838539458 2.213029294952861 1.3002898838539458 -50.669041724598216" pbc="F F F" Ta 0.00149219 0.03153344 -0.00446000 -16.33559299 -16.19079170 -14.82556538 Ta 1.63049563 1.63404518 0.02547417 17.80873585 17.54893843 -16.80744369 Ta 1.65481824 -0.02884727 1.59778712 11.50185986 -13.14602130 15.21125677 Ta 0.00253879 1.64843168 1.62751969 -12.97500272 11.78787457 16.42175231