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=111.63400889764479 stress="-11.723314550158989 0.659370355898185 3.6662542692077715 0.659370355898185 -9.93398622559222 2.0734458174766393 3.6662542692077715 2.0734458174766393 -15.637617254022652" free_energy=111.63400889764479 pbc="F F T"
Ta       0.29874826       0.05835534      -0.25354363    -124.97301557    -100.91075919      71.07728240
Ta       1.48193431       1.42001865       0.20070203     110.71473489      96.89560479     -52.71568416
Ta       1.20342959       0.28187239       1.51001192     170.95222273    -119.50073626     -36.51943888
Ta       0.10170120       1.37793365       1.21904386    -156.69394206     123.51589066      18.15784064