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=50095.69587273773 stress="-3908.9842323093285 -355.88586409595814 201.6778390274811 -355.88586409595814 -9065.81531456059 5705.090946512749 201.6778390274811 5705.090946512749 -9461.631156889467" pbc="F F T" Pu 0.06063571 0.26130634 -0.23925014 -50495.47510285 -193035.72677608 188237.24570736 Pu 1.42178582 1.30548004 -0.08345411 42236.96602903 41700.17240998 31792.40464740 Pu 1.40437617 0.10409829 1.63298888 35974.49386123 -36545.77897180 -34821.16520541 Pu 0.07105062 1.30180087 1.70214149 -27715.98478741 187881.33333790 -185208.48514935