data_[Nd2Ag6Te6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [19.8874]
_cell_length_b [5.0784]
_cell_length_c [15.1064]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [Nd(AgTe)3]
_chemical_formula_sum '[Nd2 Ag6 Te6]'
_cell_volume [1525.6949]
_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
[
  Nd  Nd0  2  0.5000  0.0000  0.1136  1
  Ag  Ag1  4  0.3973  0.0000  0.6583  1
  Ag  Ag2  2  0.5000  0.0000  0.3243  1
  Te  Te3  4  0.3771  0.0000  0.2354  1
  Te  Te4  2  0.5000  0.0000  0.5083  1
]