data_[Nd10Hg4Ge2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Hg  2.0000  1.5000  1.2450
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [6.8362]
_cell_length_b [13.0417]
_cell_length_c [5.2655]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [Nd5Hg2Ge]
_chemical_formula_sum '[Nd10 Hg4 Ge2]'
_cell_volume [469.4425]
_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
[
  Nd  Nd0  4  0.1495  0.0994  0.5000  1
  Nd  Nd1  4  0.1561  0.7849  0.0000  1
  Nd  Nd2  2  0.0000  0.5000  0.0000  1
  Hg  Hg3  4  0.1009  0.3490  0.5000  1
  Ge  Ge4  2  0.0000  0.0000  0.0000  1
]