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=3.126193485495312 stress="-1.3859947434851276 0.41376682238554063 0.45382125948021396 0.41376682238554063 -1.7842527293261214 0.4365767733382833 0.45382125948021396 0.4365767733382833 -1.3524704976258115" free_energy=3.126193485495312 pbc="T F F"
Fe       2.76922180       0.02031036       0.18745344      14.72382623     -15.19673907     -14.45211799 
Fe       1.70559557       1.37970777       0.27711528      -4.83267343      31.14827056     -18.11940443 
Fe       1.37871118       0.13616082       1.26429260      -7.70866379     -20.80106771      26.84392886 
Fe       0.20296155       1.71980528       1.79977655      -2.18248902       4.84953622       5.72759356