# generated using pymatgen
data_Li3BiF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.52612344
_cell_length_b   7.85215501
_cell_length_c   7.99552876
_cell_angle_alpha   79.97418623
_cell_angle_beta   107.54932866
_cell_angle_gamma   123.27528233
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3BiF6
_chemical_formula_sum   'Li3 Bi1 F6'
_cell_volume   376.62784522
_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  0.00000000  0.00000000  0.50000000  1
  Li  Li1  1  0.50000000  0.50000000  0.00000000  1
  Li  Li2  1  0.00000000  0.50000000  0.00000000  1
  Bi  Bi3  1  0.00000000  0.00000000  0.00000000  1
  F  F4  1  0.96073200  0.27451100  0.94346600  1
  F  F5  1  0.03926800  0.72548900  0.05653400  1
  F  F6  1  0.96477800  0.97244000  0.71207300  1
  F  F7  1  0.03522200  0.02756000  0.28792700  1
  F  F8  1  0.63789600  0.76318400  0.97096200  1
  F  F9  1  0.36210400  0.23681600  0.02903800  1
