# generated using pymatgen
data_Tl3Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.47076732
_cell_length_b   7.47064610
_cell_length_c   5.29144004
_cell_angle_alpha   90.01250106
_cell_angle_beta   89.98629955
_cell_angle_gamma   119.98747013
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl3Bi
_chemical_formula_sum   'Tl6 Bi2'
_cell_volume   255.78948602
_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
  Tl  Tl0  1  0.16892565  0.33807457  0.25005200  1.0
  Tl  Tl1  1  0.66194788  0.83107669  0.25006716  1.0
  Tl  Tl2  1  0.16884808  0.83115166  0.24988685  1.0
  Tl  Tl3  1  0.83109353  0.66190465  0.74991139  1.0
  Tl  Tl4  1  0.33806543  0.16892213  0.74993598  1.0
  Tl  Tl5  1  0.83111859  0.16887849  0.75013479  1.0
  Bi  Bi6  1  0.33337445  0.66662425  0.75001162  1.0
  Bi  Bi7  1  0.66662539  0.33337056  0.24999921  1.0