12
Lattice="6.242325291217745 -0.004021621962719299 0.0 -3.124645472666128 5.409873996962244 0.0 -8.046090579097271e-17 0.0 33.19" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-83.23485058440912 stress="8.813238488089537e-06 -1.4275289433645546e-05 2.1365506233747606e-23 -1.4275289433645546e-05 -4.8917976350558743e-05 -3.46068911770182e-23 2.1365506233747606e-23 -3.46068911770182e-23 0.00012439684773287964" dipole="15.6811605007749 -8.220658671617617 1.8332001082760814e-13" magmom=0.0 free_energy=-83.23485483923398 pbc="T T F"
Mo      -0.01008930       5.40403376      16.59500000       0.00000000      -0.00259604       0.00208224       0.00000000       0.00000000
Cr       3.12488430       5.41000174      16.59500000       0.00000000      -0.00771084      -0.00286798       0.00000000       0.00000000
Mo       1.55223343       2.69909676      16.59500000       0.00000000      -0.00259603       0.00208222       0.00000000       0.00000000
Cr       4.68720704       2.70506475      16.59500000       0.00000000      -0.00771082      -0.00286797       0.00000000       0.00000000
S        1.51002591       0.87146855      18.14131383       0.00000000       0.00464809       0.00139594       0.00331285       0.00000000
S        4.73084474       0.92697038      18.08619627       0.00000000       0.00054586      -0.00097930      -0.00705807       0.00000000
S       -0.05229682       3.57640555      18.14131383       0.00000000       0.00464807       0.00139593       0.00331286       0.00000000
S        3.16852200       3.63190738      18.08619627       0.00000000       0.00054585      -0.00097927      -0.00705807       0.00000000
S        1.51002591       0.87146855      15.04868617       0.00000000       0.00464809       0.00139594      -0.00331285       0.00000000
S        4.73084474       0.92697038      15.10380373       0.00000000       0.00054586      -0.00097930       0.00705807       0.00000000
S       -0.05229682       3.57640555      15.04868617       0.00000000       0.00464807       0.00139593      -0.00331286       0.00000000
S        3.16852200       3.63190738      15.10380373       0.00000000       0.00054585      -0.00097927       0.00705807       0.00000000