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=51.34439416599061 stress="-7.892845190100466 0.27048106542495076 1.1724935607985998 0.27048106542495076 -6.025165268270056 3.195731090061188 1.1724935607985998 3.195731090061188 -8.82659329737222" free_energy=51.34439416599061 pbc="T F F" Ta 2.90295338 0.10338854 0.24759167 91.32588115 -17.56292575 -83.40542704 Ta 1.61018303 1.42518197 0.18843096 -37.55122247 111.58935010 -135.67952099 Ta 1.67061300 0.29169807 1.21658389 -95.84853823 -120.40366189 177.53920122 Ta 2.77560094 1.53851086 1.64982991 42.07387955 26.37723754 41.54574680