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=46964.00907205421 pbc="T F T" Re -0.21872032 -0.00818366 0.21236577 75 179227.97689977 -24250.21052422 -192277.10630904 Re 1.53498621 1.22261521 0.18070896 75 -39849.62849216 30610.70458456 -37723.96786864 Re 1.77820931 -0.11007506 1.25396117 75 -170821.47339305 -45195.81815907 188760.37201563 Re -0.13324133 1.35812791 1.20209406 75 31443.12498544 38835.32409873 41240.70216205