data_[Li4Cu2Bi2P4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cu  1.9000  1.3500  0.8200
  Bi  2.0200  1.6000  1.0350
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.8366]
_cell_length_b [6.4231]
_cell_length_c [11.0023]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.2784]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Li2CuBi(PO4)2]
_chemical_formula_sum '[Li4 Cu2 Bi2 P4 O16]'
_cell_volume [341.7898]
_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
[
  Li  Li0  2  0.0000  0.0000  0.0000  1
  Li  Li1  2  0.5000  0.0000  0.5000  1
  Cu  Cu2  2  0.0302  0.7500  0.2954  1
  Bi  Bi3  2  0.4787  0.7500  0.7812  1
  P  P4  2  0.0882  0.2500  0.4162  1
  P  P5  2  0.3970  0.2500  0.9137  1
  O  O6  4  0.2056  0.0564  0.3424  1
  O  O7  4  0.2683  0.0557  0.8487  1
  O  O8  2  0.2252  0.2500  0.5428  1
  O  O9  2  0.2314  0.7500  0.5811  1
  O  O10  2  0.2532  0.2500  0.0441  1
  O  O11  2  0.2900  0.7500  0.0786  1
]