data_[Mn2Tl2Cu2O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Tl  1.6200  1.9000  1.3325
  Cu  1.9000  1.3500  0.8200
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [5.7340]
_cell_length_b [5.1599]
_cell_length_c [6.0806]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.3576]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [MnTlCuO2]
_chemical_formula_sum '[Mn2 Tl2 Cu2 O4]'
_cell_volume [175.7372]
_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
[
  Mn  Mn0  2  0.0000  0.4817  0.7500  1
  Tl  Tl1  2  0.5000  0.1812  0.2500  1
  Cu  Cu2  2  0.0000  0.0000  0.0000  1
  O  O3  4  0.1812  0.2976  0.5281  1
]