data_[Nd4Ge4O14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ge  2.0100  1.2500  0.7700
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.8294]
_cell_length_b [6.9725]
_cell_length_c [7.0004]
_cell_angle_alpha [64.3839]
_cell_angle_beta [87.4491]
_cell_angle_gamma [88.5544]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Nd2Ge2O7]
_chemical_formula_sum '[Nd4 Ge4 O14]'
_cell_volume [300.2779]
_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  1  0.1449  0.7439  0.9956  1
  Nd  Nd1  1  0.5746  0.3201  0.1530  1
  Nd  Nd2  1  0.6338  0.8305  0.6371  1
  Nd  Nd3  1  0.8719  0.3034  0.6402  1
  Ge  Ge4  1  0.0389  0.1866  0.1838  1
  Ge  Ge5  1  0.1413  0.7439  0.4994  1
  Ge  Ge6  1  0.3751  0.3124  0.6540  1
  Ge  Ge7  1  0.6810  0.7953  0.1224  1
  O  O8  1  0.1336  0.9242  0.2249  1
  O  O9  1  0.1901  0.1411  0.8034  1
  O  O10  1  0.2292  0.3679  0.1209  1
  O  O11  1  0.2368  0.5238  0.4499  1
  O  O12  1  0.2844  0.8129  0.6555  1
  O  O13  1  0.4932  0.7015  0.0129  1
  O  O14  1  0.5419  0.2004  0.5277  1
  O  O15  1  0.5458  0.4259  0.7590  1
  O  O16  1  0.5879  0.9317  0.2664  1
  O  O17  1  0.8221  0.9289  0.8789  1
  O  O18  1  0.8266  0.5632  0.2517  1
  O  O19  1  0.8626  0.2793  0.9930  1
  O  O20  1  0.9102  0.1107  0.4294  1
  O  O21  1  0.9199  0.6463  0.6342  1
]