# generated using pymatgen
data_Ti2Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.16185927
_cell_length_b   4.16054831
_cell_length_c   7.70477789
_cell_angle_alpha   105.67430261
_cell_angle_beta   105.67770895
_cell_angle_gamma   90.00526617
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2Bi
_chemical_formula_sum   'Ti4 Bi2'
_cell_volume   123.28784627
_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
  Ti  Ti0  1  0.85346648  0.85345625  0.70729916  1.0
  Ti  Ti1  1  0.49996457  -0.00003074  -0.00005597  1.0
  Ti  Ti2  1  -0.00003100  0.49996873  -0.00005613  1.0
  Ti  Ti3  1  0.14661593  0.14662799  0.29285800  1.0
  Bi  Bi4  1  0.64839131  0.64842131  0.29642433  1.0
  Bi  Bi5  1  0.35159271  0.35155646  0.70353060  1.0