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=3.305483913250073 stress="-12.658502245733484 -0.8040536367586621 0.9938583223243542 -0.8040536367586621 -11.674117792347566 0.17066266664800356 0.9938583223243542 0.17066266664800356 -12.091566748436275" pbc="F F F" Mg -0.17769156 -0.08950840 -0.27713580 -3.61845584 -3.73165702 -3.15273784 Mg 1.43858073 1.25205420 0.15488783 5.66490995 4.65744673 -4.30476265 Mg 1.55988540 -0.29754255 1.66431082 1.99698262 -3.85597716 3.45082188 Mg -0.18574270 1.48844065 1.53277713 -4.04343672 2.93018745 4.00667861