data_[Pr2Tm2S2O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Tm  1.2500  1.7500  1.0950
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.5418]
_cell_length_b [4.0797]
_cell_length_c [7.6522]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.6612]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [PrTmSO2]
_chemical_formula_sum '[Pr2 Tm2 S2 O4]'
_cell_volume [191.0920]
_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  0.3018  0.7500  0.0640  1.0
  Tm  Tm1  2  0.3259  0.7500  0.5686  1.0
  S  S2  2  0.0373  0.2500  0.7565  1.0
  O  O3  2  0.4713  0.2500  0.6044  1.0
  O  O4  2  0.4881  0.2500  0.1336  1.0
]