data_[Y1Te4Cl6]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.4495]
_cell_length_b [7.7141]
_cell_length_c [7.7687]
_cell_angle_alpha [78.9854]
_cell_angle_beta [66.9336]
_cell_angle_gamma [75.9578]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Y(Te2Cl3)2]
_chemical_formula_sum '[Y1 Te4 Cl6]'
_cell_volume [396.1605]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.0000  1.0
  Te  Te1  2  0.3402  0.7401  0.5087  1.0
  Te  Te2  2  0.3890  0.4486  0.3303  1.0
  Cl  Cl3  2  0.0177  0.2637  0.1703  1.0
  Cl  Cl4  2  0.0569  0.7643  0.2780  1.0
  Cl  Cl5  2  0.3876  0.9552  0.7963  1.0
]