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=2.87495389873 pbc="T T F" Ti 0.37762995 0.36258329 0.48722792 22 -6.49189893 -2.95990702 -10.28321726 Ti 1.64685009 1.55050631 0.28235527 22 6.93593915 4.85690891 -1.97234201 Ti 1.35402479 0.22357939 1.49207130 22 6.47592618 -9.60662665 7.77688432 Ti 0.21630158 1.53848316 1.45774659 22 -6.91996652 7.70962450 4.47867496