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=9930162.857014194 pbc="T T T" Kr -0.18564671 0.11115480 0.11044915 36 -9761332.39355572 -53195694.70938728 -34684886.57570163 Kr 0.66826113 0.42693662 0.06110600 36 7812657.92512086 40069617.61461250 -61822765.26757959 Kr 0.72413972 0.01872586 0.74443895 36 5937857.31873616 -36411306.57462444 61098106.29202788 Kr -0.22187219 0.76878885 0.57834452 36 -3989182.85030128 49537383.66939922 35409545.55125335