data_TaMn2Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.04
_cell_length_b   4.49
_cell_length_c   5.21
_cell_angle_alpha   90.0
_cell_angle_beta   97.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaMn2Bi
_chemical_formula_sum   'Ta1 Mn2 Bi1'
_cell_volume   70.69
_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
  Ta  Ta3  1  0.2  0.0  0.32  1.0
  Mn  Mn1  1  0.99  0.0  0.15  1.0
  Mn  Mn2  1  0.23  0.25  0.3  1.0
  Bi  Bi0  1  0.14  0.25  0.98  1.0

data_TaMn2Bi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.04
_cell_length_b   4.49
_cell_length_c   5.21
_cell_angle_alpha   90.0
_cell_angle_beta   97.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaMn2Bi
_chemical_formula_sum   'Ta1 Mn2 Bi1'
_cell_volume   70.69
_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
  Ta  Ta0  1  0.2  0.0  0.32  1.0
  Mn  Mn1  1  0.23  0.25  0.3  1.0
  Mn  Mn2  1  0.99  0.0  0.15  1.0
  Bi  Bi3  1  0.14  0.25  0.98  1.0

Ta Mn Mn Bi