data_[Rb2Th2Ni2Te6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Th  1.3000  1.8000  1.0800
  Ni  1.9100  1.3500  0.7400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [10.1034]
_cell_length_b [4.3700]
_cell_length_c [10.4675]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.1469]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [RbThNiTe3]
_chemical_formula_sum '[Rb2 Th2 Ni2 Te6]'
_cell_volume [433.8885]
_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
[
  Rb  Rb0  2  0.2909  0.7500  0.2457  1
  Th  Th1  2  0.1917  0.2500  0.6623  1
  Ni  Ni2  2  0.3969  0.7500  0.8778  1
  Te  Te3  2  0.0365  0.2500  0.3358  1
  Te  Te4  2  0.3375  0.2500  0.9759  1
  Te  Te5  2  0.3938  0.7500  0.6289  1
]