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=-3.263631673834886 stress="-0.8487823348718674 -0.1397016844011869 0.289479655651639 -0.1397016844011869 -2.688771947109879 0.2077042051620064 0.289479655651639 0.2077042051620064 -1.9308190586777043" free_energy=-3.263631673834886 pbc="F T T"
Fe       0.32854526       2.79590009       0.16265408      -3.01173316      12.02223115     -10.89343303 
C       1.45874788       1.50834121       2.67542126       8.84560456       5.73580764       3.43619475 
C       1.44170993       0.18168807       1.86584524       8.00043373      -5.60327103      -6.79523662 
Ti       0.03839703       1.45376057       1.22340307     -13.83430512     -12.15476777      14.25247490