8 Lattice="20.46960845140505 0.0 0.0 0.0 20.399092709338877 0.0 0.0 0.0 5.973082744039" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-694.2643654858535 dipole="3.2942647769343164e-09 2.5915666048345193e-09 -3.777657884644714e-09" magmom=1.8669858482684477e-08 free_energy=-694.2799809932795 pbc="F F T" Br 12.29575219 9.71226463 2.98654137 0.00000000 -0.00206656 0.00075574 0.00000000 0.00000000 Br 10.84348302 8.17121221 -0.00000000 0.00000000 -0.00085516 0.00213994 -0.00000002 0.00000000 Br 8.78231094 8.65820537 2.98654137 0.00000000 0.00152212 0.00149848 0.00000003 -0.00000000 Ti 10.23480423 10.19954636 4.47981206 1.00000000 -0.00000005 -0.00000004 0.00000002 0.46211028 Ti 10.23480423 10.19954635 1.49327068 -1.00000000 -0.00000004 -0.00000002 -0.00000001 -0.46211027 Br 8.17385626 10.68682808 0.00000000 0.00000000 0.00206658 -0.00075575 -0.00000000 0.00000000 Br 9.62612544 12.22788050 2.98654137 0.00000000 0.00085515 -0.00213991 0.00000002 0.00000000 Br 11.68729752 11.74088734 0.00000000 0.00000000 -0.00152209 -0.00149846 -0.00000001 -0.00000000