data_Ta5Sn3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.41
_cell_length_b   6.41
_cell_length_c   3.78
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta5Sn3
_chemical_formula_sum   'Ta5 Sn3'
_cell_volume   155.44
_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  0.43  0.0  0.0  1.0
  Ta  Ta4  1  0.21  0.68  0.0  1.0
  Ta  Ta5  1  0.21  0.32  0.0  1.0
  Ta  Ta6  1  0.67  0.0  0.89  1.0
  Ta  Ta7  1  0.18  0.0  0.89  1.0
  Sn  Sn0  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.43  0.17  0.89  1.0
  Sn  Sn2  1  0.43  0.83  0.89  1.0

data_Ta5Sn3
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.78
_cell_length_b   6.41
_cell_length_c   6.41
_cell_angle_alpha   92.66
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta5Sn3
_chemical_formula_sum   'Ta5 Sn3'
_cell_volume   155.44
_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  0.0  0.21  0.32  1.0
  Ta  Ta1  1  0.0  0.21  0.68  1.0
  Ta  Ta2  1  0.0  0.43  0.0  1.0
  Ta  Ta3  1  0.89  0.18  0.0  1.0
  Ta  Ta4  1  0.89  0.67  0.0  1.0
  Sn  Sn5  1  0.0  0.0  0.0  1.0
  Sn  Sn6  1  0.89  0.43  0.17  1.0
  Sn  Sn7  1  0.89  0.43  0.83  1.0

Ta Ta Ta Ta Ta Sn Sn Sn