data_[Li1Bi3P2O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [P1]
_cell_length_a [5.6596]
_cell_length_b [6.7318]
_cell_length_c [6.8690]
_cell_angle_alpha [106.2129]
_cell_angle_beta [108.7084]
_cell_angle_gamma [100.5778]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [LiBi3(PO5)2]
_chemical_formula_sum '[Li1 Bi3 P2 O10]'
_cell_volume [227.0314]
_cell_formula_units_Z [1]
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  1  0.7807  0.4899  0.9004  1.0
  Bi  Bi1  1  0.0245  0.0033  0.0040  1.0
  Bi  Bi2  1  0.2492  0.6056  0.6537  1.0
  Bi  Bi3  1  0.5771  0.8138  0.2491  1.0
  P  P4  1  0.2411  0.0688  0.5846  1.0
  P  P5  1  0.6379  0.3825  0.3365  1.0
  O  O6  1  0.0511  0.0554  0.3561  1.0
  O  O7  1  0.0629  0.9278  0.6625  1.0
  O  O8  1  0.1717  0.7210  0.9844  1.0
  O  O9  1  0.3606  0.3084  0.7436  1.0
  O  O10  1  0.4130  0.4882  0.3332  1.0
  O  O11  1  0.4525  0.9572  0.5683  1.0
  O  O12  1  0.5026  0.1340  0.1940  1.0
  O  O13  1  0.6571  0.7534  0.9330  1.0
  O  O14  1  0.8056  0.4908  0.2332  1.0
  O  O15  1  0.8089  0.4103  0.5756  1.0
]