data_[Pr6Te2Os2Br2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Te  2.1000  1.4000  1.2933
  Os  2.2000  1.3000  0.6730
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.6031]
_cell_length_b [4.4018]
_cell_length_c [11.3861]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.0127]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Pr3TeOsBr]
_chemical_formula_sum '[Pr6 Te2 Os2 Br2]'
_cell_volume [416.4604]
_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
[
  Pr  Pr0  2  0.0200  0.7500  0.7110  1.0
  Pr  Pr1  2  0.2691  0.7500  0.4949  1.0
  Pr  Pr2  2  0.4043  0.2500  0.7869  1.0
  Te  Te3  2  0.3780  0.2500  0.3017  1.0
  Os  Os4  2  0.1124  0.2500  0.5873  1.0
  Br  Br5  2  0.3002  0.7500  0.9510  1.0
]