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:Z:I:1:forces:R:3 energy=23.1061573811 pbc="T F T" Zr -0.15371586 -0.03020126 0.30297076 40 7.99421723 -17.99413517 -8.86200900 Zr 1.21156333 1.41738082 0.15093924 40 20.78412090 16.74353721 1.95214643 Zr 1.64313150 -0.20484213 1.64526935 40 -10.35192582 -18.20164926 8.56351418 Zr 0.22851840 1.57797747 1.69188276 40 -18.42641232 19.45224722 -1.65365161