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=45.7351248087255 stress="-4.388630725101874 0.24508975790033977 0.43518969999408874 0.24508975790033977 -6.189465178506801 0.9390492452633261 0.43518969999408874 0.9390492452633261 -5.1504648788850504" free_energy=45.7351248087255 pbc="T T T" Al 2.85540510 0.11115480 0.31304306 17.57595675 -13.39393258 -21.02114034 Al 1.70960170 1.31143450 2.54699460 -38.13544771 -20.82535557 44.31821908 Al 1.28829595 2.70059987 1.64041416 -31.11518945 39.93911587 -9.50692297 Al 2.77812781 1.51878885 1.32834452 51.67468041 -5.71982772 -13.79015578