data_[La4Pr2Y6As12]
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
  Y  1.2200  1.8000  1.0400
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.4850]
_cell_length_b [4.2469]
_cell_length_c [8.4807]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.1681]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La2Pr(YAs2)3]
_chemical_formula_sum '[La4 Pr2 Y6 As12]'
_cell_volume [648.2702]
_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
[
  La  La0  4  0.1663  0.0000  0.3326  1.0
  Pr  Pr1  2  0.0000  0.5000  0.0000  1.0
  Y  Y2  4  0.1665  0.0000  0.8337  1.0
  Y  Y3  2  0.0000  0.5000  0.5000  1.0
  As  As4  4  0.0029  0.0000  0.7445  1.0
  As  As5  4  0.1638  0.5000  0.5904  1.0
  As  As6  4  0.1689  0.5000  0.0759  1.0
]