# generated using pymatgen
data_LiBi(PO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.72722258
_cell_length_b   10.72722258
_cell_length_c   5.30673978
_cell_angle_alpha   77.53557162
_cell_angle_beta   77.53557162
_cell_angle_gamma   68.78050639
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBi(PO3)4
_chemical_formula_sum   'Li2 Bi2 P8 O24'
_cell_volume   549.44548113
_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  0.00000000  0.50000000  0.00000000  1
  Li  Li1  1  0.50000000  0.00000000  0.00000000  1
  Bi  Bi2  1  0.64855200  0.64855200  0.31003000  1
  Bi  Bi3  1  0.35144800  0.35144800  0.68997000  1
  P  P4  1  0.30136900  0.06464800  0.53759300  1
  P  P5  1  0.60797500  0.22376300  0.16446500  1
  P  P6  1  0.39202500  0.77623700  0.83553500  1
  P  P7  1  0.77623700  0.39202500  0.83553500  1
  P  P8  1  0.69863100  0.93535200  0.46240700  1
  P  P9  1  0.22376300  0.60797500  0.16446500  1
  P  P10  1  0.06464800  0.30136900  0.53759300  1
  P  P11  1  0.93535200  0.69863100  0.46240700  1
  O  O12  1  0.13005100  0.37819200  0.65149700  1
  O  O13  1  0.33867100  0.05055800  0.25750800  1
  O  O14  1  0.26674700  0.73325300  0.00000000  1
  O  O15  1  0.73325300  0.26674700  0.00000000  1
  O  O16  1  0.66132900  0.94944200  0.74249200  1
  O  O17  1  0.94944200  0.66132900  0.74249200  1
  O  O18  1  0.21750900  0.51768600  0.98933500  1
  O  O19  1  0.51768600  0.21750900  0.98933500  1
  O  O20  1  0.30489300  0.92510600  0.72395200  1
  O  O21  1  0.92510600  0.30489300  0.72395200  1
  O  O22  1  0.45680300  0.68908300  0.62267700  1
  O  O23  1  0.68908300  0.45680300  0.62267700  1
  O  O24  1  0.85833800  0.85833800  0.38872500  1
  O  O25  1  0.62180800  0.86994900  0.34850300  1
  O  O26  1  0.78249100  0.48231400  0.01066500  1
  O  O27  1  0.37819200  0.13005100  0.65149700  1
  O  O28  1  0.86994900  0.62180800  0.34850300  1
  O  O29  1  0.14166200  0.14166200  0.61127500  1
  O  O30  1  0.31091700  0.54319700  0.37732300  1
  O  O31  1  0.54319700  0.31091700  0.37732300  1
  O  O32  1  0.07489400  0.69510700  0.27604800  1
  O  O33  1  0.69510700  0.07489400  0.27604800  1
  O  O34  1  0.48231400  0.78249100  0.01066500  1
  O  O35  1  0.05055800  0.33867100  0.25750800  1
