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=319702.58881788736 pbc="F T F" Ra 0.24195650 0.08013568 -0.18863950 88 -759238.92417729 -460874.76793569 -404206.75199278 Ra 1.57376597 1.21639626 -0.02058504 88 663431.13018133 522358.76269361 -202267.02182250 Ra 1.38834545 -0.22432546 1.26901013 88 446267.95388550 -222949.52088992 388232.94345801 Ra 0.19567075 1.21181462 1.51315591 88 -350460.15988953 161465.52613200 218240.83035727