data_[La8Pr4Zn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.3286]
_cell_length_b [6.4306]
_cell_length_c [6.9769]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.0281]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La2PrZn2]
_chemical_formula_sum '[La8 Pr4 Zn8]'
_cell_volume [590.5893]
_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
[
  La  La0  8  0.1410  0.1115  0.1216  1.0
  Pr  Pr1  4  0.0000  0.4152  0.7500  1.0
  Zn  Zn2  8  0.1755  0.3740  0.5261  1.0
]