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=37.620468755455285 pbc="T F T" Pb -0.22461850 -0.29703668 -0.15112699 82 3.51121010 -14.64354891 3.44533524 Pb 1.72083292 1.28984966 -0.01264569 82 -4.10448159 12.02043706 3.14255422 Pb 1.42299150 -0.09301634 1.68107110 82 -3.57029266 -11.94340887 -4.32446329 Pb -0.17174679 1.63102478 1.59995250 82 4.16356415 14.56652073 -2.26342617