12
Lattice="7.161425386935734 -2.0913989004939853e-20 0.0 -3.580712693467865 6.259917444150325 0.0 -1.307641456356756e-19 0.0 18.75832809354433" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1 energy=-69.6766974020171 dipole="11.077449494846158 -5.943352127800015 2.999946038175062e-10" magmom=3.076440866656867 free_energy=-69.70325987168593 pbc="T T F"
Zr       0.00623854      -0.00786289       9.37753547       0.40595190       0.40599698
S        1.77575939       1.05593185      10.83985878       0.01588146       0.01585836
Br       1.79913430       1.03830778       7.48823445      -0.00198467      -0.00199706
Zr      -1.78411781       3.12209582       9.38079262       0.40595190       0.40599698
Br       0.00877796       4.16826650      11.27009364      -0.00198467      -0.00199706
S       -0.01459695       4.18589057       7.91846931       0.01588146       0.01585836
Zr       3.58695122      -0.00786290       9.38079264       0.40595191       0.40599698
Br       5.37984700       1.03830778      11.27009363      -0.00198467      -0.00199706
S        5.35647208       1.05593184       7.91846932       0.01588146       0.01585836
Zr       1.79659487       3.12209582       9.37753546       0.40595191       0.40599698
S        3.56611573       4.18589057      10.83985878       0.01588146       0.01585836
Br       3.58949066       4.16826649       7.48823445      -0.00198467      -0.00199706