data_[Ba2Nd2Ni2Sb2O12]
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
  Ni  1.9100  1.3500  0.7400
  Sb  2.0500  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pc]
_cell_length_a [5.7256]
_cell_length_b [5.7887]
_cell_length_c [9.8782]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.4577]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [7]
_chemical_formula_structural [BaNdNiSbO6]
_chemical_formula_sum '[Ba2 Nd2 Ni2 Sb2 O12]'
_cell_volume [266.6813]
_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  2  0.2503  0.2595  0.2494  1.0
  Nd  Nd1  2  0.7298  0.2044  0.7480  1.0
  Ni  Ni2  2  0.4962  0.2587  0.9994  1.0
  Sb  Sb3  2  0.9995  0.2559  0.5001  1.0
  O  O4  2  0.1410  0.2608  0.7421  1.0
  O  O5  2  0.2799  0.0054  0.5387  1.0
  O  O6  2  0.3287  0.4577  0.5485  1.0
  O  O7  2  0.7217  0.0083  0.4678  1.0
  O  O8  2  0.7500  0.4670  0.9510  1.0
  O  O9  2  0.8028  0.2160  0.2550  1.0
]