data_[Pr3Ag1Ge6Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ag  1.9300  1.6000  1.0867
  Ge  2.0100  1.2500  0.7700
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.0725]
_cell_length_b [6.0725]
_cell_length_c [8.3438]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Pr3Ag(Ge3Pt)2]
_chemical_formula_sum '[Pr3 Ag1 Ge6 Pt2]'
_cell_volume [266.4567]
_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
[
  Pr  Pr0  2  0.3333  0.6667  0.6374  1
  Pr  Pr1  1  0.0000  0.0000  0.0000  1
  Ag  Ag2  1  0.0000  0.0000  0.5000  1
  Ge  Ge3  6  0.1914  0.3828  0.2795  1
  Pt  Pt4  2  0.3333  0.6667  0.0223  1
]