data_[Pr16Tl4Co4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Tl  1.6200  1.9000  1.3325
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.9241]
_cell_length_b [7.2150]
_cell_length_c [6.2460]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.2041]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr4TlCo]
_chemical_formula_sum '[Pr16 Tl4 Co4]'
_cell_volume [715.7452]
_cell_formula_units_Z [4]
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  8  0.1172  0.2489  0.6045  1.0
  Pr  Pr1  4  0.0000  0.2296  0.0000  1.0
  Pr  Pr2  4  0.1877  0.5000  0.1709  1.0
  Tl  Tl3  4  0.1965  0.0000  0.1984  1.0
  Co  Co4  4  0.0084  0.5000  0.3064  1.0
]