# generated using pymatgen
data_LuCoBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.84012203
_cell_length_b   3.84012184
_cell_length_c   11.28022830
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001016
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuCoBr
_chemical_formula_sum   'Lu2 Co2 Br2'
_cell_volume   144.05837330
_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
  Lu  Lu0  1  0.00000000  0.00000000  0.16404467  1.0
  Lu  Lu1  1  0.00000000  0.00000000  0.83595533  1.0
  Co  Co2  1  0.66666700  0.33333400  0.00975448  1.0
  Co  Co3  1  0.33333400  0.66666700  0.99024552  1.0
  Br  Br4  1  0.33333400  0.66666700  0.32950331  1.0
  Br  Br5  1  0.66666700  0.33333400  0.67049669  1.0