data_[Ce2Ag2Pd2Se6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.7122]
_cell_length_b [4.0711]
_cell_length_c [9.0281]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.7849]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CeAgPdSe3]
_chemical_formula_sum '[Ce2 Ag2 Pd2 Se6]'
_cell_volume [277.4818]
_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
[
  Ce  Ce0  2  0.1828  0.7500  0.2359  1
  Ag  Ag1  2  0.3375  0.2500  0.8218  1
  Pd  Pd2  2  0.1112  0.7500  0.6018  1
  Se  Se3  2  0.0825  0.7500  0.8820  1
  Se  Se4  2  0.2312  0.2500  0.4872  1
  Se  Se5  2  0.4130  0.2500  0.1537  1
]