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=81.70283471756161 stress="-4.202844404700723 0.10717085842508192 -0.00987962709241725 0.10717085842508192 -4.122701139180854 0.10230316546313442 -0.00987962709241725 0.10230316546313442 -9.24764745213504" pbc="F F T" Cd 0.10170120 0.00082602 0.24624097 -38.02030116 -37.15256464 -6.76167732 Cd 1.64302402 1.35498893 0.11042859 37.06621223 39.32010302 -10.82118472 Cd 1.70947124 0.05280714 1.22759613 36.21230942 -40.77188806 10.29891071 Cd 0.15488783 1.55988540 1.20245745 -35.25822049 38.60434967 7.28395133