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=48080.2435660038 stress="-152512.5829215911 -8381.948566623363 -4113.501798913239 -8381.948566623363 -218466.26380714233 -103989.8247730604 -4113.501798913239 -103989.8247730604 -214014.97463950218" pbc="F F F" Ra -0.21952087 0.15215541 -0.10590602 -54184.01119672 -102374.33852419 -113043.41194217 Ra 1.74609838 1.35832550 -0.03962901 60418.10615157 17696.30630674 -39615.82619226 Ra 1.23736946 -0.29894610 1.53525338 28848.94800212 -37983.96618900 37650.23943801 Ra 0.01638122 1.61949563 1.24051514 -35083.04295696 122661.99840645 115008.99869641