data_[Ba8Ho4Mn4Te20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ho  1.2300  1.7500  1.0410
  Mn  1.5500  1.4000  0.6483
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.5511]
_cell_length_b [20.0093]
_cell_length_c [14.2674]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ba2HoMnTe5]
_chemical_formula_sum '[Ba8 Ho4 Mn4 Te20]'
_cell_volume [1299.2422]
_cell_formula_units_Z [4]
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
[
  Ba  Ba0  4  0.0000  0.1190  0.3354  1.0
  Ba  Ba1  4  0.0000  0.1279  0.6937  1.0
  Ho  Ho2  4  0.0000  0.1963  0.0287  1.0
  Mn  Mn3  4  0.0000  0.4368  0.4248  1.0
  Te  Te4  4  0.0000  0.0378  0.0179  1.0
  Te  Te5  4  0.0000  0.3063  0.6722  1.0
  Te  Te6  4  0.0000  0.3081  0.3754  1.0
  Te  Te7  4  0.0000  0.3452  0.0132  1.0
  Te  Te8  4  0.0000  0.4965  0.2625  1.0
]