data_[U8Te4H12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Te  2.1000  1.4000  1.2933
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.8454]
_cell_length_b [7.0868]
_cell_length_c [13.4245]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [U2TeH3]
_chemical_formula_sum '[U8 Te4 H12]'
_cell_volume [365.8426]
_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
[
  U  U0  4  0.0000  0.0000  0.3561  1
  U  U1  4  0.0000  0.1740  0.0000  1
  Te  Te2  4  0.0000  0.5000  0.3381  1
  H  H3  8  0.0000  0.3565  0.1266  1
  H  H4  4  0.0000  0.1508  0.5000  1
]