1
Lattice="0.0 2.497597 -2.497597 2.497597 2.497597 -2.220446049250313e-16 2.4975969999999994 6.661338147750939e-16 -2.497597" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3.7586164779250892 stress="-0.00428467089820281 8.295571229871537e-19 -8.814044431738509e-19 8.295571229871537e-19 -0.004284670898202812 1.2443356844807306e-18 -8.814044431738509e-19 1.2443356844807306e-18 -0.004284670898202809" pbc="T T T"
Pb       0.00000000       0.00000000       0.00000000      -0.00000000      -0.00000000      -0.00000000