data_[Ba12Nd4Ga8O30]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Nd  1.1400  1.8500  1.2765
  Ga  1.8100  1.3000  0.7600
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [8.1553]
_cell_length_b [6.1129]
_cell_length_c [18.8518]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.0541]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [Ba6Nd2Ga4O15]
_chemical_formula_sum '[Ba12 Nd4 Ga8 O30]'
_cell_volume [939.6443]
_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
[
  Ba  Ba0  4  0.0323  0.2590  0.0913  1
  Ba  Ba1  4  0.4993  0.2444  0.4199  1
  Ba  Ba2  2  0.0000  0.2748  0.7500  1
  Ba  Ba3  2  0.5000  0.3346  0.7500  1
  Nd  Nd4  4  0.2476  0.2550  0.9096  1
  Ga  Ga5  4  0.2285  0.2224  0.2636  1
  Ga  Ga6  4  0.2467  0.2456  0.5606  1
  O  O7  4  0.0505  0.2399  0.6115  1
  O  O8  4  0.2346  0.4931  0.5013  1
  O  O9  4  0.2371  0.0019  0.0001  1
  O  O10  4  0.2542  0.4398  0.3340  1
  O  O11  4  0.2730  0.0478  0.8039  1
  O  O12  4  0.3084  0.3233  0.1799  1
  O  O13  4  0.4627  0.2425  0.5952  1
  O  O14  2  0.0000  0.2110  0.2500  1
]