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=45.73581057010623 stress="-4.388652826905277 0.24505533738818497 0.4351400761739106 0.24505533738818497 -6.189486231088563 0.9390739444442966 0.4351400761739106 0.9390739444442966 -5.150421046982124" free_energy=45.73581057010623 pbc="T T T" Al 2.85540510 0.11115480 0.31304306 17.57593038 -13.39490552 -21.02149170 Al 1.70960170 1.31143450 2.54699460 -38.13664388 -20.82474824 44.31921072 Al 1.28829595 2.70059987 1.64041416 -31.11536647 39.93964737 -9.50782807 Al 2.77812781 1.51878885 1.32834452 51.67607997 -5.71999360 -13.78989095