data_[Pr8Ga2Cl10]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.5637]
_cell_length_b [4.1597]
_cell_length_c [8.5224]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5650]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr4GaCl5]
_chemical_formula_sum '[Pr8 Ga2 Cl10]'
_cell_volume [636.9433]
_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  0.0001  0.0000  0.7611  1.0
  Pr  Pr1  4  0.1572  0.5000  0.0949  1.0
  Ga  Ga2  2  0.0000  0.5000  0.0000  1.0
  Cl  Cl3  4  0.1658  0.0000  0.3302  1.0
  Cl  Cl4  4  0.1704  0.0000  0.8596  1.0
  Cl  Cl5  2  0.0000  0.5000  0.5000  1.0
]