12
Lattice="5.543850878256623 7.638237267564169e-21 0.0 -5.872867919140447e-17 8.157093363226132 0.0 -2.6338681754364053e-17 -4.708503219818702e-34 33.40903118202214" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-54.37783205088668 stress="-1.3722536949341115e-05 0.0 -6.8218182478925875e-06 0.0 -7.5330643971277955e-06 0.0 -6.8218182478925875e-06 0.0 2.496250556350745e-05" dipole="-25.70695303294299 -1.964172614533489e-12 3.1288640958606134e-07" magmom=0.0 free_energy=-54.37783296568652 pbc="T T F"
P       -0.11914541      -0.00000000      15.73539299       0.00000000      -0.00142938       0.00000000      -0.00424238       0.00000000
P        0.52711131       4.07854668      15.44750907       0.00000000      -0.00694271       0.00000000       0.00219483       0.00000000
S        2.67896160       4.07854668      15.63989885       0.00000000       0.00503863       0.00000000      -0.00466380       0.00000000
S        3.24726517      -0.00000000      15.93748745       0.00000000      -0.00391691       0.00000000       0.00396181       0.00000000
S        0.32533225       1.64253996      14.65850054       0.00000000       0.00061713      -0.00283973      -0.00270106       0.00000000
S        0.32533225       6.51455340      14.65850054       0.00000000       0.00061713       0.00283973      -0.00270106       0.00000000
P        3.33961451       4.07854668      17.67365853       0.00000000       0.00035197       0.00000000       0.00414333       0.00000000
P        2.69330994      -0.00000000      17.96154366       0.00000000       0.00689675       0.00000000      -0.00241635       0.00000000
S        0.54144589       0.00000000      17.76908452       0.00000000      -0.00500443       0.00000000       0.00548214       0.00000000
S        5.51697072       4.07854668      17.47157028       0.00000000       0.00458430       0.00000000      -0.00380961       0.00000000
S        2.89505454       5.72111015      18.75054803       0.00000000      -0.00040639      -0.00336549       0.00237653       0.00000000
S        2.89505454       2.43598322      18.75054803       0.00000000      -0.00040639       0.00336549       0.00237653       0.00000000