data_[Sb2Ir30]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [4.7183]
_cell_length_b [35.1848]
_cell_length_c [4.7195]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5715]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [SbIr15]
_chemical_formula_sum '[Sb2 Ir30]'
_cell_volume [738.2275]
_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
[
  Sb  Sb0  2  0.0000  0.2001  0.7500  1
  Ir  Ir1  2  0.0000  0.2472  0.2500  1
  Ir  Ir2  2  0.0000  0.2870  0.7500  1
  Ir  Ir3  2  0.0000  0.3256  0.2500  1
  Ir  Ir4  2  0.0000  0.3645  0.7500  1
  Ir  Ir5  2  0.0000  0.4029  0.2500  1
  Ir  Ir6  2  0.0000  0.4417  0.7500  1
  Ir  Ir7  2  0.0000  0.4807  0.2500  1
  Ir  Ir8  2  0.5000  0.2118  0.2500  1
  Ir  Ir9  2  0.5000  0.2472  0.7500  1
  Ir  Ir10  2  0.5000  0.2870  0.2500  1
  Ir  Ir11  2  0.5000  0.3256  0.7500  1
  Ir  Ir12  2  0.5000  0.3642  0.2500  1
  Ir  Ir13  2  0.5000  0.4030  0.7500  1
  Ir  Ir14  2  0.5000  0.4419  0.2500  1
  Ir  Ir15  2  0.5000  0.4806  0.7500  1
]