data_[Cs2Tm2Fe2O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tm  1.2500  1.7500  1.0950
  Fe  1.8300  1.4000  0.8525
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.2884]
_cell_length_b [3.5745]
_cell_length_c [9.5287]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.2226]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsTmFeO3]
_chemical_formula_sum '[Cs2 Tm2 Fe2 O6]'
_cell_volume [231.4128]
_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
[
  Cs  Cs0  2  0.3316  0.7500  0.2925  1
  Tm  Tm1  2  0.1267  0.7500  0.6517  1
  Fe  Fe2  2  0.3384  0.2500  0.9343  1
  O  O3  2  0.0801  0.2500  0.7820  1
  O  O4  2  0.1744  0.2500  0.5149  1
  O  O5  2  0.4332  0.7500  0.8651  1
]