data_[Hf2Mn4Te8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Mn  1.5500  1.4000  0.6483
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.5494]
_cell_length_b [4.0292]
_cell_length_c [7.2051]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.4866]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Hf(MnTe2)2]
_chemical_formula_sum '[Hf2 Mn4 Te8]'
_cell_volume [367.6737]
_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
[
  Hf  Hf0  2  0.0000  0.0000  0.0000  1
  Mn  Mn1  4  0.2496  0.0000  0.2843  1
  Te  Te2  4  0.1174  0.0000  0.4589  1
  Te  Te3  4  0.1337  0.5000  0.9641  1
]