data_SrTa2Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.05
_cell_length_b   6.05
_cell_length_c   3.06
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   118.51
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTa2Bi
_chemical_formula_sum   'Sr1 Ta2 Bi1'
_cell_volume   98.21
_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
  Sr  Sr1  1  0.0  0.0  0.0  1.0
  Ta  Ta2  1  0.55  0.6  0.53  1.0
  Ta  Ta3  1  0.55  0.4  0.53  1.0
  Bi  Bi0  1  0.09  0.0  0.0  1.0

data_SrTa2Bi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.06
_cell_length_b   6.05
_cell_length_c   6.05
_cell_angle_alpha   118.51
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTa2Bi
_chemical_formula_sum   'Sr1 Ta2 Bi1'
_cell_volume   98.21
_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
  Sr  Sr0  1  0.0  0.0  0.0  1.0
  Ta  Ta1  1  0.53  0.55  0.4  1.0
  Ta  Ta2  1  0.53  0.55  0.6  1.0
  Bi  Bi3  1  0.0  0.09  0.0  1.0

Sr Ta Ta Bi
Sr Ta Ta Bi 0 3 o o o 1 2 o o o 