data_[Pr4Zn2Si2]
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
  Si  1.9000  1.1000  0.5400
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.0720]
_cell_length_b [4.1281]
_cell_length_c [8.7118]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.9069]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Pr2ZnSi]
_chemical_formula_sum '[Pr4 Zn2 Si2]'
_cell_volume [205.3211]
_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  0.2133  0.2500  0.4198  1.0
  Pr  Pr1  2  0.2853  0.7500  0.0629  1.0
  Zn  Zn2  2  0.1637  0.2500  0.7761  1.0
  Si  Si3  2  0.3581  0.7500  0.7083  1.0
]