256 Lattice="16.01523598669703 0.0 0.0 0.0 16.01523598669703 0.0 0.0 0.0 16.01523598669703" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1797.0021352157664 stress="-0.007753743528378436 -0.0003129303046798091 -3.7146936776343176e-05 -0.0003129303046798091 -0.0077909798161624 3.741272433258557e-05 -3.7146936776343176e-05 3.741272433258557e-05 -0.00782045149664863" free_energy=-1797.0021352157664 pbc="F F F" Ta 0.03153093 0.00686129 0.01047583 1.82145782 1.77561766 1.71256682 Ta 1.98222790 1.97982524 0.00272417 -0.38652989 -0.39538506 -0.21580865 Ta 1.98544229 0.03831874 2.03162340 -0.32872977 -0.42118910 -0.57443305 Ta 0.00275457 2.02278811 1.98228866 -0.37454966 -0.56379338 -0.29305460 Ta 4.01265507 0.02599584 0.01696889 -0.07172220 1.10966752 1.02094628 Ta 6.04186804 2.02248315 0.00754510 -0.13165165 -0.33271081 -0.35466499 Ta 6.00095708 0.01810327 2.00135980 0.06473505 -0.48525441 -0.39214857 Ta 4.01809270 2.02045003 2.03492351 -0.46844409 -0.96131521 -0.91637931 Ta 7.96569972 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