data_[La6Pr2Er4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Er  1.2400  1.7500  1.0300
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.7619]
_cell_length_b [13.4122]
_cell_length_c [7.7921]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6078]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La3Pr(ErTe3)2]
_chemical_formula_sum '[La6 Pr2 Er4 Te12]'
_cell_volume [764.1502]
_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
[
  La  La0  4  0.0000  0.1591  0.5000  1.0
  La  La1  2  0.0000  0.5000  0.5000  1.0
  Pr  Pr2  2  0.0000  0.0000  0.0000  1.0
  Er  Er3  4  0.0000  0.3326  0.0000  1.0
  Te  Te4  8  0.2479  0.3274  0.7615  1.0
  Te  Te5  4  0.2313  0.5000  0.2307  1.0
]