data_[Tm14Te6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P6_3mc]
_cell_length_a [9.6458]
_cell_length_b [9.6458]
_cell_length_c [7.0842]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [186]
_chemical_formula_structural [Tm7Te3]
_chemical_formula_sum '[Tm14 Te6]'
_cell_volume [570.8174]
_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
[
  Tm  Tm0  6  0.0768  0.5384  0.1709  1.0
  Tm  Tm1  6  0.1230  0.2461  0.4512  1.0
  Tm  Tm2  2  0.3333  0.6667  0.5235  1.0
  Te  Te3  6  0.2027  0.4054  0.8394  1.0
]