data_[Pr16Zn4Ga2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.5210]
_cell_length_b [5.2026]
_cell_length_c [7.4083]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.4396]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr8Zn2Ga]
_chemical_formula_sum '[Pr16 Zn4 Ga2]'
_cell_volume [668.9043]
_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  0.0234  0.0000  0.7751  1.0
  Pr  Pr1  4  0.0905  0.5000  0.4598  1.0
  Pr  Pr2  4  0.1699  0.5000  0.9765  1.0
  Pr  Pr3  4  0.1970  0.0000  0.3116  1.0
  Zn  Zn4  4  0.1770  0.0000  0.6984  1.0
  Ga  Ga5  2  0.0000  0.5000  0.0000  1.0
]