data_[Pm1Ag5Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Ag  1.9300  1.6000  1.0867
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.2021]
_cell_length_b [7.7630]
_cell_length_c [7.9326]
_cell_angle_alpha [118.1257]
_cell_angle_beta [104.4738]
_cell_angle_gamma [94.0845]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [PmAg5Cl8]
_chemical_formula_sum '[Pm1 Ag5 Cl8]'
_cell_volume [369.3322]
_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
[
  Pm  Pm0  1  0.5352  0.6905  0.3229  1
  Ag  Ag1  1  0.0366  0.5198  0.4160  1
  Ag  Ag2  1  0.0564  0.9491  0.4292  1
  Ag  Ag3  1  0.4274  0.0648  0.0406  1
  Ag  Ag4  1  0.5596  0.5263  0.7904  1
  Ag  Ag5  1  0.9625  0.4186  0.8571  1
  Cl  Cl6  1  0.1932  0.3484  0.6288  1
  Cl  Cl7  1  0.2064  0.7957  0.1442  1
  Cl  Cl8  1  0.2407  0.3391  0.1356  1
  Cl  Cl9  1  0.3513  0.8240  0.6272  1
  Cl  Cl10  1  0.6746  0.8776  0.1304  1
  Cl  Cl11  1  0.7087  0.4869  0.5181  1
  Cl  Cl12  1  0.7209  0.4146  0.0706  1
  Cl  Cl13  1  0.8264  0.9946  0.6390  1
]