data_[Y8Te10H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Te  2.1000  1.4000  1.2933
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [21.1799]
_cell_length_b [4.2099]
_cell_length_c [8.4811]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.0134]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Y4Te5H2]
_chemical_formula_sum '[Y8 Te10 H4]'
_cell_volume [733.7261]
_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
[
  Y  Y0  4  0.0416  0.0000  0.2704  1
  Y  Y1  4  0.1699  0.5000  0.5302  1
  Te  Te2  4  0.0941  0.0000  0.6605  1
  Te  Te3  4  0.1887  0.0000  0.2777  1
  Te  Te4  2  0.0000  0.5000  0.0000  1
  H  H5  4  0.0756  0.5000  0.3540  1
]