data_[Pr16Ga4Ag2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.9689]
_cell_length_b [5.2143]
_cell_length_c [7.0121]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.5582]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr8Ga2Ag]
_chemical_formula_sum '[Pr16 Ga4 Ag2]'
_cell_volume [681.8172]
_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  0.0287  0.0000  0.7587  1.0
  Pr  Pr1  4  0.0919  0.5000  0.4570  1.0
  Pr  Pr2  4  0.1609  0.5000  0.9645  1.0
  Pr  Pr3  4  0.2021  0.0000  0.3097  1.0
  Ga  Ga4  4  0.1937  0.0000  0.7480  1.0
  Ag  Ag5  2  0.0000  0.5000  0.0000  1.0
]