data_[Ta10Sb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.1970]
_cell_length_b [3.4876]
_cell_length_c [6.7204]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0210]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ta5Sb]
_chemical_formula_sum '[Ta10 Sb2]'
_cell_volume [225.9510]
_cell_formula_units_Z [2]
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  4  0.1656  0.5000  0.3375  1.0
  Ta  Ta1  4  0.1739  0.5000  0.8240  1.0
  Ta  Ta2  2  0.0000  0.0000  0.5000  1.0
  Sb  Sb3  2  0.0000  0.0000  0.0000  1.0
]