data_[Pr1Ge4Ir3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ge  2.0100  1.2500  0.7700
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [5.8813]
_cell_length_b [3.9553]
_cell_length_c [6.4840]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0083]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [PrGe4Ir3]
_chemical_formula_sum '[Pr1 Ge4 Ir3]'
_cell_volume [150.8327]
_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  1  0.1749  0.0000  0.4820  1
  Ge  Ge1  1  0.0997  0.5000  0.1215  1
  Ge  Ge2  1  0.4393  0.5000  0.7459  1
  Ge  Ge3  1  0.6424  0.0000  0.2774  1
  Ge  Ge4  1  0.8794  0.0000  0.8518  1
  Ir  Ir5  1  0.3160  0.0000  0.9932  1
  Ir  Ir6  1  0.6862  0.5000  0.0425  1
  Ir  Ir7  1  0.7620  0.5000  0.4856  1
]