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=113.23566018235792 stress="-231.34947393907473 1.5766194861707756 -35.236414195115614 1.5766194861707756 -205.97303161091818 3.0636941442253516 -35.236414195115614 3.0636941442253516 -174.46467355590943" pbc="F F F" Se 0.25980354 -0.03332758 0.27143892 -113.57326478 -64.10291426 -92.74057055 Se 1.40295338 1.60338854 0.24759167 51.44197801 84.86139243 -56.40103452 Se 1.61018303 -0.07481803 1.24663523 116.74258281 -64.22564369 86.49427926 Se -0.01297511 1.44857885 1.68843096 -54.61129604 43.46716553 62.64732581