# generated using pymatgen
data_LiUBr4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.34779240
_cell_length_b   7.34779240
_cell_length_c   12.72381100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000364
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiUBr4
_chemical_formula_sum   'Li3 U3 Br12'
_cell_volume   594.92412527
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.00000000  0.00000000  0.00000000  1
  Li  Li1  1  0.66666700  0.33333300  0.50000000  1
  Li  Li2  1  0.33333300  0.66666700  0.50000000  1
  U  U3  1  0.66666700  0.33333300  0.00000000  1
  U  U4  1  0.33333300  0.66666700  0.00000000  1
  U  U5  1  0.00000000  0.00000000  0.50000000  1
  Br  Br6  1  0.33296500  0.33296500  0.61760200  1
  Br  Br7  1  0.66703500  0.66703500  0.38239800  1
  Br  Br8  1  0.66703500  0.00000000  0.61760200  1
  Br  Br9  1  0.33296500  0.00000000  0.38239800  1
  Br  Br10  1  0.00000000  0.66703500  0.61760200  1
  Br  Br11  1  0.00000000  0.33296500  0.38239800  1
  Br  Br12  1  0.32011500  0.32011500  0.12334200  1
  Br  Br13  1  0.67988500  0.67988500  0.87665800  1
  Br  Br14  1  0.67988500  0.00000000  0.12334200  1
  Br  Br15  1  0.32011500  0.00000000  0.87665800  1
  Br  Br16  1  0.00000000  0.67988500  0.12334200  1
  Br  Br17  1  0.00000000  0.32011500  0.87665800  1
