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=15.0910597298 stress="-10.076117907953693 2.3043018664755563 2.295379336809596 2.3043018664755563 -8.270033849112135 0.46840483790547555 2.295379336809596 0.46840483790547555 -8.830663766300608" pbc="F F F" Ti 0.23171545 0.18190327 -0.17816502 -5.24096662 -6.62733940 -8.08627601 Ti 1.71219253 1.42485375 0.12990665 11.75283111 9.27083319 -11.29530305 Ti 1.28220450 0.28278197 1.56210000 14.42782268 -19.06664066 9.35003672 Ti 0.13362859 1.32702941 1.57034430 -20.93968717 16.42314687 10.03154233