data_[Nd6Zn45Ge6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Zn  1.6500  1.3500  0.8800
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [9.3109]
_cell_length_b [9.3109]
_cell_length_c [12.9695]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Nd2Zn15Ge2]
_chemical_formula_sum '[Nd6 Zn45 Ge6]'
_cell_volume [973.7350]
_cell_formula_units_Z [3]
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
[
  Nd  Nd0  6  0.0000  0.0000  0.3336  1.0
  Zn  Zn1  18  0.0000  0.3088  0.0000  1.0
  Zn  Zn2  18  0.0148  0.5074  0.1558  1.0
  Zn  Zn3  9  0.0000  0.5000  0.5000  1.0
  Ge  Ge4  6  0.0000  0.0000  0.0991  1.0
]