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=6.034932595433247 stress="-78.00908212689194 -5.43671697952938 -10.063385389833577 -5.43671697952938 -78.18890293831834 3.9168257431340976 -10.063385389833577 3.9168257431340976 -78.41566596967098" pbc="F F F" U 0.06804991 -0.01654669 0.03283230 -31.32675307 -29.02481061 -27.29695725 U 1.56494667 1.43148128 -0.05373817 22.78570731 30.43658274 -23.59649222 U 1.54591429 0.05072181 1.52085833 28.12757498 -25.23047584 32.21490381 U -0.05103649 1.48702364 1.55523623 -19.58652922 23.81870370 18.67854565