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=7.972524278000519 stress="-1.2214280201074392 -0.07123120185781365 0.045977310676962486 -0.07123120185781365 -1.852183799080004 0.07275658393425831 0.045977310676962486 0.07275658393425831 -1.2093658987451372" pbc="F T F" Ti 0.05473499 -0.12063495 0.13661615 -14.38354018 0.66625817 -13.30683887 Ti 1.40480033 1.28303047 0.11041876 12.19646849 0.51959417 -12.53697662 Ti 1.26735611 -0.16466555 1.24148635 13.92087475 1.06580346 12.59129627 Ti 0.08611608 1.53369179 1.52598936 -11.73380307 -2.25165580 13.25251922