5
Lattice="3.7760839822328998 0.7893845961276023 0.0 1.1656963870571382 3.6270856493027424 0.0 -1.8585506378641053e-18 2.4533976115804184e-24 21.49066344" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-21.766787891816215 stress="5.061856077179402e-06 2.1427619685095286e-06 4.377580682888459e-25 2.1427619685095286e-06 1.3802064152407659e-05 1.8530828471793824e-25 4.377580682888459e-25 1.8530828471793824e-25 0.00014155838953223624" dipole="2.4018103048754047 14.175767601862523 1.1358925088693022e-13" magmom=0.0 free_energy=-21.766787899615668 pbc="T T F"
Al       0.82227299       2.24811195      12.85866334       0.00000000       0.00003698       0.00152275      -0.00615193       0.00000000
Al       0.82227299       2.24811195       8.63200010       0.00000000       0.00003698       0.00152275       0.00615193       0.00000000
Se       2.43905689       3.72975959      13.99042411       0.00000000      -0.00056027      -0.00005029      -0.00119657       0.00000000
Se       2.43905689       3.72975959       7.50023933       0.00000000      -0.00056027      -0.00005029       0.00119657       0.00000000
Se       3.64476394       3.35302543      10.74533172       0.00000000       0.00089630      -0.00289451       0.00000000       0.00000000