data_[Rb4Gd4Ni4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Gd  1.2000  1.8000  1.0750
  Ni  1.9100  1.3500  0.7400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [11.0090]
_cell_length_b [4.3875]
_cell_length_c [16.0563]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [RbGdNiTe3]
_chemical_formula_sum '[Rb4 Gd4 Ni4 Te12]'
_cell_volume [775.5501]
_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
[
  Rb  Rb0  4  0.0409  0.2500  0.6663  1
  Gd  Gd1  4  0.1538  0.7500  0.9431  1
  Ni  Ni2  4  0.1504  0.2500  0.1224  1
  Te  Te3  4  0.0339  0.7500  0.1174  1
  Te  Te4  4  0.1826  0.7500  0.5104  1
  Te  Te5  4  0.2271  0.2500  0.2708  1
]