data_[In12Sb4Pd24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Sb  2.0500  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [7.9195]
_cell_length_b [13.5212]
_cell_length_c [6.9816]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [In3SbPd6]
_chemical_formula_sum '[In12 Sb4 Pd24]'
_cell_volume [747.5994]
_cell_formula_units_Z [4]
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
[
  In  In0  8  0.1981  0.1086  0.0201  1.0
  In  In1  4  0.0000  0.4652  0.1945  1.0
  Sb  Sb2  4  0.0000  0.2053  0.4950  1.0
  Pd  Pd3  8  0.1825  0.2882  0.2103  1.0
  Pd  Pd4  8  0.2362  0.4211  0.9004  1.0
  Pd  Pd5  4  0.0000  0.0394  0.7022  1.0
  Pd  Pd6  4  0.0000  0.2649  0.8612  1.0
]