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=39.75578347662296 stress="-2.1426301744376177 -0.014681688178844467 0.25717803988636634 -0.014681688178844467 -2.5559870452870306 -0.12192292915799219 0.25717803988636634 -0.12192292915799219 -3.084248514561229" free_energy=39.75578347662296 pbc="F T T" F 0.04052745 2.73417086 2.72098992 -18.67082709 7.73158670 1.81495262 F 1.68168807 1.64109445 0.31383843 20.78566470 -8.87879216 -7.18909763 F 1.45376057 2.72340307 1.61951579 18.14337252 11.26348531 3.29712579 F 0.13443557 1.56717778 1.19287673 -20.25821014 -10.11627984 2.07701922