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=134.10808554001096 stress="-5.3040116586166794 0.10928873262988709 0.6821241671099444 0.10928873262988709 -4.586216480903401 0.15109342846799503 0.6821241671099444 0.15109342846799503 -9.768303255403262" free_energy=134.10808554001096 pbc="F F T" Na 0.29740139 0.29004027 2.69193990 -68.86510258 -58.04807735 18.96339892 Na 1.40063274 1.27324282 0.06444632 66.13790010 57.50072440 -3.67947746 Na 1.30758850 0.24909591 1.53646942 65.58042512 -61.79586705 -14.27661736 Na 0.23384982 1.32885096 1.30600166 -62.85322264 62.34322000 -1.00730410