data_[Zr4Pa2Ag4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Pa  1.5000  1.8000  1.0400
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1561]
_cell_length_b [12.4040]
_cell_length_c [7.5975]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.5583]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zr2Pa(AgTe3)2]
_chemical_formula_sum '[Zr4 Pa2 Ag4 Te12]'
_cell_volume [668.5307]
_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
[
  Zr  Zr0  4  0.0000  0.3412  0.5000  1
  Pa  Pa1  2  0.0000  0.0000  0.5000  1
  Ag  Ag2  4  0.0000  0.1127  0.0000  1
  Te  Te3  8  0.2074  0.1779  0.7349  1
  Te  Te4  4  0.1893  0.5000  0.7478  1
]