data_[In4Ga12Pd24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [9.0105]
_cell_length_b [12.1196]
_cell_length_c [6.1765]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [In(GaPd2)3]
_chemical_formula_sum '[In4 Ga12 Pd24]'
_cell_volume [674.4992]
_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  4  0.0000  0.2119  0.0409  1.0
  Ga  Ga1  8  0.1630  0.1184  0.4501  1.0
  Ga  Ga2  4  0.0000  0.4392  0.3317  1.0
  Pd  Pd3  8  0.2044  0.4604  0.6264  1.0
  Pd  Pd4  8  0.2313  0.3035  0.2936  1.0
  Pd  Pd5  4  0.0000  0.0319  0.7663  1.0
  Pd  Pd6  4  0.0000  0.2762  0.6064  1.0
]