data_[Ga2Te2H2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Te  2.1000  1.4000  1.2933
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.1409]
_cell_length_b [4.1409]
_cell_length_c [11.4400]
_cell_angle_alpha [88.4613]
_cell_angle_beta [88.1723]
_cell_angle_gamma [60.0151]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [GaTeH]
_chemical_formula_sum '[Ga2 Te2 H2]'
_cell_volume [169.8081]
_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
[
  Ga  Ga0  1  0.7216  0.1884  0.3924  1.0
  Ga  Ga1  1  0.7356  0.1967  0.1759  1.0
  Te  Te2  1  0.0474  0.5172  0.5043  1.0
  Te  Te3  1  0.0766  0.5345  0.0639  1.0
  H  H4  1  0.6835  0.1835  0.8042  1.0
  H  H5  1  0.7829  0.2419  0.7596  1.0
]