data_LaMnBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.25
_cell_length_b   6.25
_cell_length_c   6.25
_cell_angle_alpha   146.12
_cell_angle_beta   129.46
_cell_angle_gamma   62.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMnBi2
_chemical_formula_sum   'La1 Mn1 Bi2'
_cell_volume   103.95
_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
  La  La2  1  0.0  0.67  0.41  1.0
  Mn  Mn3  1  0.0  0.0  0.17  1.0
  Bi  Bi0  1  0.0  0.67  0.78  1.0
  Bi  Bi1  1  0.0  0.0  0.68  1.0

data_LaMnBi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.64
_cell_length_b   5.34
_cell_length_c   6.25
_cell_angle_alpha   115.27
_cell_angle_beta   106.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMnBi2
_chemical_formula_sum   'La1 Mn1 Bi2'
_cell_volume   103.95
_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
  La  La0  1  0.33  0.74  0.74  1.0
  Mn  Mn1  1  0.0  0.17  0.17  1.0
  Bi  Bi2  1  0.0  0.68  0.68  1.0
  Bi  Bi3  1  0.33  0.12  0.12  1.0

La Mn Bi Bi
La Mn Bi Bi 0 3 o + o 1 2 o - - 