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=15.1491315814 stress="-5.546466758012673 -0.5547601393924112 -0.8895790836901725 -0.5547601393924112 -5.28651059095352 0.43693234483289156 -0.8895790836901725 0.43693234483289156 -5.327535350817081" pbc="F F F" Li 0.06109240 -0.29967995 0.16886747 -13.77153388 -10.66757661 -10.70928977 Li 1.54810421 1.45353077 -0.15533360 6.93554715 10.56760537 -11.58899482 Li 1.46448728 0.11524669 1.36267039 14.14131426 -7.41423454 17.00676576 Li -0.21696224 1.72725014 1.46525369 -7.30532752 7.51420578 5.29151883