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=26.720833089994542 stress="-2.849084216768087 0.018615364140542726 -0.17207424073073052 0.018615364140542726 -2.121054568858329 -0.01988930277304463 -0.17207424073073052 -0.01988930277304463 -1.5246401044763587" free_energy=26.720833089994542 pbc="T F F" Mg 0.16980798 0.02184289 0.15019543 6.93124474 -16.07770756 -16.67411468 Mg 1.63350600 1.64618898 0.23454065 -9.90074365 19.86600871 -16.85888273 Mg 1.77437118 0.03310309 1.31305510 -7.92025414 -21.32956511 14.23898294 Mg 2.84472026 1.46070040 1.49928290 10.88975305 17.54126396 19.29401447