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=123972.00882382634 stress="-18864.781202985418 4088.3044923308585 -1936.8500905493393 4088.3044923308585 -24487.32512916824 -1259.9189830478701 -1936.8500905493393 -1259.9189830478701 -12527.690501263842" pbc="F T F" Ce 0.28422576 -0.21035627 0.03752516 -159428.48012526 86987.74002816 -135333.27263354 Ce 1.77163620 1.60180170 0.24839775 164947.80462017 -120199.05249224 -78208.17484793 Ce 1.31391047 -0.14243609 1.72261111 231226.19027325 63237.30756449 168544.70613555 Ce 0.17476674 1.36803203 1.60935651 -236745.51476816 -30025.99510041 44996.74134592