data_[Mn4Tl6V2Te12]
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
  V  1.6300  1.3500  0.7775
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1628]
_cell_length_b [12.4183]
_cell_length_c [8.1534]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0311]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mn2Tl3VTe6]
_chemical_formula_sum '[Mn4 Tl6 V2 Te12]'
_cell_volume [693.4367]
_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  4  0.0000  0.3332  0.0000  1
  Tl  Tl1  4  0.0000  0.1651  0.5000  1
  Tl  Tl2  2  0.0000  0.5000  0.5000  1
  V  V3  2  0.0000  0.0000  0.0000  1
  Te  Te4  8  0.2290  0.1663  0.1897  1
  Te  Te5  4  0.2304  0.5000  0.1881  1
]