data_[Li1Pm2Ge1Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pm  1.1300  1.8500  1.1100
  Ge  2.0100  1.2500  0.7700
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.2602]
_cell_length_b [6.2692]
_cell_length_c [7.1073]
_cell_angle_alpha [88.7882]
_cell_angle_beta [71.4665]
_cell_angle_gamma [78.6768]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [LiPm2GeAu6]
_chemical_formula_sum '[Li1 Pm2 Ge1 Au6]'
_cell_volume [217.6841]
_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
[
  Li  Li0  1  0.0000  0.5000  0.5000  1
  Pm  Pm1  2  0.4561  0.2159  0.7292  1
  Ge  Ge2  1  0.0000  0.0000  0.0000  1
  Au  Au3  2  0.0041  0.1273  0.3381  1
  Au  Au4  2  0.1789  0.5765  0.0933  1
  Au  Au5  2  0.4865  0.2895  0.2950  1
]