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=247.97024115769477 stress="-37.492475739484014 7.617568999350201 15.988555594327734 7.617568999350201 -57.108173269309134 23.633718365225068 15.988555594327734 23.633718365225068 -35.45863642434268" free_energy=247.97024115769477 pbc="T F F" U 2.76922180 0.02031036 0.18745344 435.23317792 -366.75085026 -267.54150736 U 1.70559557 1.37970777 0.27711528 -55.50712203 1079.35346129 -649.08906536 U 1.37871118 0.13616082 1.26429260 -320.58172500 -820.43271137 821.92778929 U 0.20296155 1.59406387 1.56542501 -59.14433089 107.83010034 94.70278343