data_[La2Nd1Te1O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Nd  1.1400  1.8500  1.2765
  Te  2.1000  1.4000  1.2933
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.4105]
_cell_length_b [7.3026]
_cell_length_c [5.5502]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.8832]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [La2NdTeO8]
_chemical_formula_sum '[La2 Nd1 Te1 O8]'
_cell_volume [178.3519]
_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
[
  La  La0  2  0.5000  0.2485  0.5000  1
  Nd  Nd1  1  0.0000  0.5000  0.0000  1
  Te  Te2  1  0.0000  0.0000  0.0000  1
  O  O3  4  0.0679  0.2018  0.7700  1
  O  O4  2  0.4012  0.0000  0.1700  1
  O  O5  2  0.4526  0.5000  0.2518  1
]