data_[Yb2Ge3Pd1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Yb  1.1000  1.7500  1.0840
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [4.0420]
_cell_length_b [4.3352]
_cell_length_c [7.4097]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Yb2Ge3Pd]
_chemical_formula_sum '[Yb2 Ge3 Pd1]'
_cell_volume [129.8408]
_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
[
  Yb  Yb0  1  0.0000  0.0000  0.5066  1.0
  Yb  Yb1  1  0.0000  0.5000  0.9923  1.0
  Ge  Ge2  1  0.5000  0.0000  0.1646  1.0
  Ge  Ge3  1  0.5000  0.0000  0.8321  1.0
  Ge  Ge4  1  0.5000  0.5000  0.3348  1.0
  Pd  Pd5  1  0.5000  0.5000  0.6695  1.0
]