data_[Nd14In2Ge10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  In  1.7800  1.5500  0.9400
  Ge  2.0100  1.2500  0.7700
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [6.2362]
_cell_length_b [11.2295]
_cell_length_c [10.2429]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [Nd7InGe5]
_chemical_formula_sum '[Nd14 In2 Ge10]'
_cell_volume [717.3030]
_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  0.0000  0.3171  0.0198  1
  Nd  Nd1  4  0.0000  0.3342  0.4579  1
  Nd  Nd2  2  0.0000  0.0000  0.3497  1
  Nd  Nd3  2  0.0000  0.0000  0.7272  1
  Nd  Nd4  2  0.0000  0.5000  0.7094  1
  In  In5  2  0.0000  0.0000  0.0357  1
  Ge  Ge6  8  0.2120  0.2615  0.7488  1
  Ge  Ge7  2  0.0000  0.5000  0.2274  1
]