# generated using pymatgen
data_La3Lu2In3Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.52220401
_cell_length_b   9.52220398
_cell_length_c   6.77073782
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000352
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3Lu2In3Br
_chemical_formula_sum   'La6 Lu4 In6 Br2'
_cell_volume   531.66928996
_cell_formula_units_Z   2
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
  La  La0  1  0.72959441  0.72959441  0.25000000  1.0
  La  La1  1  0.00000000  0.72959441  0.75000000  1.0
  La  La2  1  0.72959441  0.00000000  0.75000000  1.0
  La  La3  1  0.27040559  0.27040559  0.75000000  1.0
  La  La4  1  1.00000000  0.27040559  0.25000000  1.0
  La  La5  1  0.27040559  1.00000000  0.25000000  1.0
  Lu  Lu6  1  0.33333300  0.66666700  0.50000000  1.0
  Lu  Lu7  1  0.66666700  0.33333300  0.50000000  1.0
  Lu  Lu8  1  0.33333300  0.66666700  0.00000000  1.0
  Lu  Lu9  1  0.66666700  0.33333300  0.00000000  1.0
  In  In10  1  0.39267491  0.00000000  0.75000000  1.0
  In  In11  1  1.00000000  0.60732509  0.25000000  1.0
  In  In12  1  0.60732509  1.00000000  0.25000000  1.0
  In  In13  1  0.00000000  0.39267491  0.75000000  1.0
  In  In14  1  0.39267491  0.39267491  0.25000000  1.0
  In  In15  1  0.60732509  0.60732509  0.75000000  1.0
  Br  Br16  1  0.00000000  0.00000000  0.50000000  1.0
  Br  Br17  1  0.00000000  0.00000000  0.00000000  1.0