data_[Lu2Ge6Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Lu  1.2700  1.7500  1.0010
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [6.3745]
_cell_length_b [6.3123]
_cell_length_c [5.7776]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.6670]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LuGe3Pd]
_chemical_formula_sum '[Lu2 Ge6 Pd2]'
_cell_volume [195.7034]
_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
[
  Lu  Lu0  2  0.0714  0.5000  0.1634  1
  Ge  Ge1  4  0.1008  0.2490  0.6960  1
  Ge  Ge2  2  0.4875  0.5000  0.9791  1
  Pd  Pd3  2  0.2426  0.0000  0.4715  1
]