data_[Pr2Mn2Tl2Te6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Mn  1.5500  1.4000  0.6483
  Tl  1.6200  1.9000  1.3325
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [9.7405]
_cell_length_b [4.5533]
_cell_length_c [10.3114]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.2338]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [PrMnTlTe3]
_chemical_formula_sum '[Pr2 Mn2 Tl2 Te6]'
_cell_volume [441.2569]
_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  0.3289  0.7500  0.8547  1.0
  Mn  Mn1  2  0.0849  0.2500  0.6021  1.0
  Tl  Tl2  2  0.2006  0.2500  0.2175  1.0
  Te  Te3  2  0.0989  0.2500  0.8665  1.0
  Te  Te4  2  0.2072  0.7500  0.5231  1.0
  Te  Te5  2  0.4505  0.7500  0.1730  1.0
]