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=17229.25623164866 stress="-93454.66113691493 27724.731718835388 -32427.292721241298 27724.731718835388 -45573.94002315542 -16534.33941177449 -32427.292721241298 -16534.33941177449 -70438.04763888994" pbc="F F F" Ho 0.10491190 -0.07361414 0.07343925 -33753.00625814 -14238.10990079 -44966.55078825 Ho 1.68297297 1.45841216 -0.16027194 3498.49187910 5614.79157875 -5078.78844551 Ho 1.22617349 0.17654183 1.41468440 68425.99497473 -24066.40652796 38969.31219308 Ho -0.18877300 1.24154796 1.60681190 -38171.48059569 32689.72485000 11076.02704067