10 Lattice="-2.546052 4.409891 0.0 5.092104 0.0 0.0 2.546052 -1.469963 -4.617045" Properties=species:S:1:pos:R:3:forces:R:3 energy=-86.70938370293709 stress="-0.02579022083236435 0.0006667064674632792 4.941765152926619e-05 0.0006667064674632792 -0.025011095700931782 -2.7212648617594475e-05 4.941765152926619e-05 -2.7212648617594475e-05 -0.033434325709251395" dipole="-2.785246418609159e-05 -6.128389843965159e-05 0.00011565746560057584" pbc="T T T" O 1.74983000 -0.09087000 -1.15426000 -0.00144311 0.00948899 0.00699898 O 1.59245000 2.93993000 -1.15426000 0.00481501 -0.00418001 -0.00677033 O 4.29588000 1.56083000 -1.15426000 -0.00473566 -0.00370817 -0.00168626 O 0.79622000 1.37910000 -3.46278000 0.00475923 0.00369521 0.00160907 O 3.49966000 0.00000000 -3.46278000 -0.00496134 0.00412354 0.00674046 O 3.34227000 3.03079000 -3.46278000 0.00147521 -0.00944727 -0.00702188 Ti 2.54605000 1.46996000 -0.17012000 -0.00005083 -0.00032968 -0.01655163 Ti 5.09210000 0.00000000 -2.13840000 -0.00044273 -0.00034547 0.01661790 Ti -0.00000000 2.93993000 -2.47864000 0.00048855 0.00030288 -0.01673516 Ti 2.54605000 1.46996000 -4.44693000 0.00009129 0.00040156 0.01688041