# generated using pymatgen
data_Li8BiS6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.11463059
_cell_length_b   7.11463059
_cell_length_c   13.47914300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000549
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8BiS6
_chemical_formula_sum   'Li16 Bi2 S12'
_cell_volume   590.87769901
_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  0.67406600  0.76550000  1.0
  Li  Li1  1  0.00000000  0.61119200  0.13280500  1.0
  Li  Li2  1  0.00000000  0.38880800  0.63280500  1.0
  Li  Li3  1  0.00000000  0.32593400  0.26550000  1.0
  Li  Li4  1  0.33333300  0.66666700  0.39609100  1.0
  Li  Li5  1  0.33333300  0.66666700  0.89609100  1.0
  Li  Li6  1  0.32593400  0.32593400  0.76550000  1.0
  Li  Li7  1  0.38880800  0.38880800  0.13280500  1.0
  Li  Li8  1  0.61119200  0.61119200  0.63280500  1.0
  Li  Li9  1  0.32593400  0.00000000  0.26550000  1.0
  Li  Li10  1  0.67406600  0.67406600  0.26550000  1.0
  Li  Li11  1  0.38880800  0.00000000  0.63280500  1.0
  Li  Li12  1  0.66666700  0.33333300  0.89609100  1.0
  Li  Li13  1  0.66666700  0.33333300  0.39609100  1.0
  Li  Li14  1  0.61119200  0.00000000  0.13280500  1.0
  Li  Li15  1  0.67406600  0.00000000  0.76550000  1.0
  Bi  Bi16  1  0.00000000  0.00000000  0.99220500  1.0
  Bi  Bi17  1  0.00000000  0.00000000  0.49220500  1.0
  S  S18  1  0.00000000  0.64643300  0.95027600  1.0
  S  S19  1  0.00000000  0.35356700  0.45027600  1.0
  S  S20  1  0.33333300  0.66666700  0.21363300  1.0
  S  S21  1  0.00000000  0.00000000  0.18818400  1.0
  S  S22  1  0.00000000  0.00000000  0.68818400  1.0
  S  S23  1  0.33333300  0.66666700  0.71363300  1.0
  S  S24  1  0.35356700  0.35356700  0.95027600  1.0
  S  S25  1  0.35356700  0.00000000  0.45027600  1.0
  S  S26  1  0.64643300  0.64643300  0.45027600  1.0
  S  S27  1  0.66666700  0.33333300  0.71363300  1.0
  S  S28  1  0.66666700  0.33333300  0.21363300  1.0
  S  S29  1  0.64643300  0.00000000  0.95027600  1.0