12
Lattice="6.561367463777594 0.0036305504934091605 0.0 -3.2775395826852174 5.678713739396991 0.0 -1.4061811711938213e-16 0.0 33.19" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-86.60191545479205 stress="3.1830540040682256e-06 1.6780013359814156e-05 1.3485840916576736e-23 1.6780013359814156e-05 4.3077702375192066e-05 7.10929160555923e-23 1.3485840916576736e-23 7.10929160555923e-23 8.266109339969458e-05" dipole="12.992191321039323 -7.18865480168411 -2.4591093609634104e-13" magmom=0.0 free_energy=-86.62307735411527 pbc="T T F"
Mo       0.00947455       5.68419487      16.59500000       0.00000000      -0.00346509      -0.00430433       0.00000000       0.00000000
Ta       3.27066163       5.67475271      16.59500000       0.00000000      -0.00044228      -0.00302028       0.00000000       0.00000000
Mo       1.64824434       2.84483800      16.59500000       0.00000000      -0.00346508      -0.00430433       0.00000000       0.00000000
Ta       4.90943143       2.83539584      16.59500000       0.00000000      -0.00044233      -0.00302033       0.00000000       0.00000000
S        1.66294731       0.96040726      18.13509267       0.00000000       0.00239712       0.00272215      -0.00271097       0.00000000
S        4.90289070       0.93869461      18.15797686       0.00000000      -0.00045388       0.00093454      -0.00369574       0.00000000
S        0.02417752       3.79976412      18.13509267       0.00000000       0.00239704       0.00272209      -0.00271091       0.00000000
S        3.26412091       3.77805149      18.15797686       0.00000000      -0.00045391       0.00093458      -0.00369572       0.00000000
S        1.66294731       0.96040726      15.05490733       0.00000000       0.00239712       0.00272215       0.00271097       0.00000000
S        4.90289070       0.93869461      15.03202314       0.00000000      -0.00045388       0.00093454       0.00369574       0.00000000
S        0.02417752       3.79976412      15.05490733       0.00000000       0.00239704       0.00272209       0.00271091       0.00000000
S        3.26412091       3.77805149      15.03202314       0.00000000      -0.00045391       0.00093458       0.00369572       0.00000000