7
Lattice="4.987071383180452 1.2496081497128693e-18 0.0 -2.493535691590197 6.551220014868642 0.0 -3.3261846430314626e-16 -8.244289798886616e-32 31.731040000000004" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-25.03241524891836 stress="-8.61049432118367e-06 3.765133151741469e-20 -9.025891992207726e-23 3.765133151741469e-20 -0.0001426647984257222 0.0 -9.025891992207726e-23 0.0 0.0001803338798392836" dipole="-1.7318493193019845e-13 7.818996601172973e-14 7.742332189874027e-13" magmom=0.0 free_energy=-25.03249575004017 pbc="T T F"
Cu      -0.00000000      -0.00000000      16.55479087       0.00000000       0.00000000       0.00000000      -0.00271954       0.00000000
Cu       2.49353569       0.00000000      15.17624913       0.00000000      -0.00000000       0.00000000       0.00271954       0.00000000
Se       1.24676785       3.27561001      15.86552000       0.00000000       0.00000000       0.00000000       0.00000000       0.00000000
S        0.13439679       1.99826416      17.30179968       0.00000000      -0.00774977       0.00572281      -0.00126974       0.00000000
S        0.13439679       4.55295585      14.42924032       0.00000000      -0.00774977      -0.00572281       0.00126974       0.00000000
S        2.35913891       4.55295585      17.30179968       0.00000000       0.00774977      -0.00572281      -0.00126974       0.00000000
S        2.35913891       1.99826416      14.42924032       0.00000000       0.00774977       0.00572281       0.00126974       0.00000000