data_[Ta2Mn4Tl6O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Mn  1.5500  1.4000  0.6483
  Tl  1.6200  1.9000  1.3325
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.6764]
_cell_length_b [9.9002]
_cell_length_c [6.7399]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.4650]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TaMn2Tl3O6]
_chemical_formula_sum '[Ta2 Mn4 Tl6 O12]'
_cell_volume [365.0471]
_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
[
  Ta  Ta0  2  0.0000  0.0000  0.0000  1.0
  Mn  Mn1  4  0.0000  0.3328  0.0000  1.0
  Tl  Tl2  4  0.0000  0.1691  0.5000  1.0
  Tl  Tl3  2  0.0000  0.5000  0.5000  1.0
  O  O4  8  0.2081  0.1498  0.1634  1.0
  O  O5  4  0.2421  0.0000  0.8239  1.0
]