data_TaIn5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.36
_cell_length_b   8.54
_cell_length_c   8.54
_cell_angle_alpha   21.88
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaIn5
_chemical_formula_sum   'Ta1 In5'
_cell_volume   145.57
_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  Ta5  1  0.68  0.0  0.9  1.0
  In  In0  1  0.0  0.0  0.75  1.0
  In  In1  1  0.0  0.0  0.18  1.0
  In  In2  1  0.0  0.0  0.61  1.0
  In  In3  1  0.68  0.0  0.29  1.0
  In  In4  1  0.68  0.0  0.75  1.0

data_TaIn5
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.24
_cell_length_b   5.36
_cell_length_c   8.54
_cell_angle_alpha   90.0
_cell_angle_beta   100.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaIn5
_chemical_formula_sum   'Ta1 In5'
_cell_volume   145.57
_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  0.1  0.68  0.1  1.0
  In  In1  1  0.25  0.68  0.25  1.0
  In  In2  1  0.25  0.0  0.25  1.0
  In  In3  1  0.39  0.0  0.39  1.0
  In  In4  1  0.71  0.68  0.71  1.0
  In  In5  1  0.82  0.0  0.82  1.0

Ta In In In In In