# generated using pymatgen
data_MgBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.77624462
_cell_length_b   5.77624462
_cell_length_c   6.02019846
_cell_angle_alpha   71.26803655
_cell_angle_beta   71.26803655
_cell_angle_gamma   65.09023088
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgBi
_chemical_formula_sum   'Mg3 Bi3'
_cell_volume   168.43986303
_cell_formula_units_Z   3
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
  Mg  Mg0  1  0.66262500  0.00235000  0.00320500  1.0
  Mg  Mg1  1  0.99765000  0.33737500  0.99679500  1.0
  Mg  Mg2  1  0.50186100  0.49813900  0.50000000  1.0
  Bi  Bi3  1  0.38027900  0.61972100  0.00000000  1.0
  Bi  Bi4  1  0.15016500  0.19258100  0.49631900  1.0
  Bi  Bi5  1  0.80741900  0.84983500  0.50368100  1.0