# generated using pymatgen
data_LiNb3(Bi2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.69466390
_cell_length_b   7.69466390
_cell_length_c   12.25300206
_cell_angle_alpha   80.05054554
_cell_angle_beta   80.05054554
_cell_angle_gamma   60.84877041
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNb3(Bi2O7)2
_chemical_formula_sum   'Li2 Nb6 Bi8 O28'
_cell_volume   620.73428043
_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  1  0.46697800  0.53302200  0.75000000  1
  Li  Li1  1  0.53302200  0.46697800  0.25000000  1
  Nb  Nb2  1  0.87415200  0.62097400  0.73960000  1
  Nb  Nb3  1  0.37902600  0.12584800  0.76040000  1
  Nb  Nb4  1  0.12876000  0.87124000  0.25000000  1
  Nb  Nb5  1  0.62097400  0.87415200  0.23960000  1
  Nb  Nb6  1  0.12584800  0.37902600  0.26040000  1
  Nb  Nb7  1  0.87124000  0.12876000  0.75000000  1
  Bi  Bi8  1  0.27559900  0.49250400  0.50567800  1
  Bi  Bi9  1  0.02398300  0.74171800  0.97673800  1
  Bi  Bi10  1  0.97601700  0.25828200  0.02326200  1
  Bi  Bi11  1  0.50749600  0.72440100  0.99432200  1
  Bi  Bi12  1  0.74171800  0.02398300  0.47673800  1
  Bi  Bi13  1  0.72440100  0.50749600  0.49432200  1
  Bi  Bi14  1  0.25828200  0.97601700  0.52326200  1
  Bi  Bi15  1  0.49250400  0.27559900  0.00567800  1
  O  O16  1  0.85997900  0.14830300  0.58416700  1
  O  O17  1  0.38486900  0.57729600  0.91085400  1
  O  O18  1  0.14830300  0.85997900  0.08416700  1
  O  O19  1  0.15151500  0.26762300  0.41405000  1
  O  O20  1  0.14947400  0.44376400  0.08652400  1
  O  O21  1  0.42270400  0.61513100  0.58914600  1
  O  O22  1  0.92384900  0.85349200  0.77129400  1
  O  O23  1  0.14002100  0.85169700  0.41583300  1
  O  O24  1  0.26762300  0.15151500  0.91405000  1
  O  O25  1  0.14650800  0.07615100  0.72870600  1
  O  O26  1  0.85052600  0.55623600  0.91347600  1
  O  O27  1  0.85349200  0.92384900  0.27129400  1
  O  O28  1  0.61513100  0.42270400  0.08914600  1
  O  O29  1  0.22674000  0.55901000  0.28135000  1
  O  O30  1  0.55623600  0.85052600  0.41347600  1
  O  O31  1  0.44376400  0.14947400  0.58652400  1
  O  O32  1  0.55901000  0.22674000  0.78135000  1
  O  O33  1  0.77326000  0.44099000  0.71865000  1
  O  O34  1  0.84852000  0.55921000  0.28327300  1
  O  O35  1  0.15148000  0.44079000  0.71672700  1
  O  O36  1  0.44099000  0.77326000  0.21865000  1
  O  O37  1  0.55921000  0.84852000  0.78327300  1
  O  O38  1  0.84848500  0.73237700  0.58595000  1
  O  O39  1  0.57729600  0.38486900  0.41085400  1
  O  O40  1  0.85169700  0.14002100  0.91583300  1
  O  O41  1  0.44079000  0.15148000  0.21672700  1
  O  O42  1  0.73237700  0.84848500  0.08595000  1
  O  O43  1  0.07615100  0.14650800  0.22870600  1
