data_[Nb2In2P4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nb  1.6000  1.4500  0.8200
  In  1.7800  1.5500  0.9400
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.7917]
_cell_length_b [5.3106]
_cell_length_c [8.5587]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.6278]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NbIn(PO4)2]
_chemical_formula_sum '[Nb2 In2 P4 O16]'
_cell_volume [399.5736]
_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
[
  Nb  Nb0  2  0.0000  0.0000  0.0000  1
  In  In1  2  0.0000  0.0000  0.5000  1
  P  P2  4  0.1525  0.5000  0.7970  1
  O  O3  8  0.0554  0.2644  0.8432  1
  O  O4  4  0.1962  0.5000  0.6289  1
  O  O5  4  0.2077  0.0000  0.0867  1
]