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=-1.1247266897629655 stress="-2.1773206223174153 0.2502214901044559 -0.2590462448441726 0.2502214901044559 -1.4446345287324438 -0.02333036596219702 -0.2590462448441726 -0.02333036596219702 -1.5747587427327736" free_energy=-1.1247266897629655 pbc="F T F"
Ti       0.28148913       0.05210001       0.26147517     -28.64694682       9.75499547     -21.51792058 
C       1.50736779       1.50505582       0.17858111      16.71463720     -10.34643029     -15.88374308 
Fe       1.58352372       2.84376228       1.26820562      29.14423768       4.49144306      20.58960749 
C       0.26111147       1.72232616       1.47927008     -17.21192807      -3.90000824      16.81205617