data_[Pr4Y14In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Y  1.2200  1.8000  1.0400
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.6642]
_cell_length_b [9.8526]
_cell_length_c [8.5776]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.9808]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr2Y7In2]
_chemical_formula_sum '[Pr4 Y14 In4]'
_cell_volume [696.4610]
_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  4  0.0000  0.3206  0.5000  1.0
  Y  Y1  8  0.2028  0.3203  0.1739  1.0
  Y  Y2  4  0.1433  0.0000  0.4154  1.0
  Y  Y3  2  0.0000  0.0000  0.0000  1.0
  In  In4  4  0.1272  0.5000  0.8412  1.0
]