3 Lattice="3.563994044027661 -2.422067433312591e-19 0.0 -2.901009900394294e-18 3.5639940440278686 0.0 -3.0101403922646676e-17 3.923360956547376e-37 18.676955262170047" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-12.368430156218825 stress="-1.0055508250840878e-05 0.0 -1.6206330831795126e-23 0.0 -1.0055508250843367e-05 0.0 -1.6206330831795126e-23 0.0 -2.4731694324278062e-06" dipole="1.2450409327693556e-17 6.043252756835991e-16 1.708976197579297e-12" magmom=0.0 free_energy=-12.37225293377024 pbc="T T F" Al -0.00000000 -0.00000000 9.33847763 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 Se -0.00000000 1.78199702 10.94546978 0.00000000 -0.00000000 0.00000000 0.00139249 0.00000000 Se 1.78199702 0.00000000 7.73148549 0.00000000 0.00000000 0.00000000 -0.00139249 0.00000000