data_[Mn2Tl2Ga2Te6]
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
  Ga  1.8100  1.3000  0.7600
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.8669]
_cell_length_b [3.9207]
_cell_length_c [10.6995]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.2441]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [MnTlGaTe3]
_chemical_formula_sum '[Mn2 Tl2 Ga2 Te6]'
_cell_volume [353.2661]
_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  0.3482  0.2500  0.8397  1
  Tl  Tl1  2  0.2365  0.7500  0.2875  1
  Ga  Ga2  2  0.1076  0.7500  0.5597  1
  Te  Te3  2  0.1229  0.7500  0.8195  1
  Te  Te4  2  0.3462  0.2500  0.5835  1
  Te  Te5  2  0.4204  0.2500  0.1077  1
]