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=-13.46006821738574 stress="-0.7376206852004484 -0.28282934888655514 -0.24727091408348992 -0.28282934888655514 -0.864903497439237 -0.04860685698645783 -0.24727091408348992 -0.04860685698645783 0.04323728808444494" free_energy=-13.46006821738574 pbc="T T T"
C       0.13918523       2.95677659       0.21538298      -1.72576736       2.22646440      -2.76254260 
C       1.33542991       1.21290831       2.75636321       1.86191933       1.56354755       5.11514650 
Fe       1.38979497       0.00239915       1.54278917      15.38813027       8.29387084      -2.06376620 
Fe       0.23520322       1.74421963       1.60654035     -15.52428223     -12.08388279      -0.28883770