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=-9.288561714557373 pbc="F T F" C 0.09851223 0.21863911 -0.11769072 6 -1.53110228 0.00075407 -3.01272377 C 1.73624620 1.24348754 -0.17613075 6 0.92704967 0.06133723 1.37121054 Fe 1.40022344 -0.19865200 1.25463684 26 6.92238509 2.07893237 -1.40495304 Fe 0.09325006 1.43926330 1.31382609 26 -6.31833248 -2.14102367 3.04646627