data_[Te2H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Te  2.1000  1.4000  1.2933
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.0954]
_cell_length_b [4.1336]
_cell_length_c [7.5074]
_cell_angle_alpha [104.5017]
_cell_angle_beta [101.7889]
_cell_angle_gamma [90.0386]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TeH]
_chemical_formula_sum '[Te2 H2]'
_cell_volume [120.2660]
_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
[
  Te  Te0  2  0.2357  0.2338  0.4375  1.0
  H  H1  2  0.0173  0.4436  0.0322  1.0
]